Introduction：Basic information about CAS 200801-70-3|(Rac)-5-Hydroxymethyl Tolterodine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (Rac)-5-Hydroxymethyl Tolterodine |
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| CAS Number | 200801-70-3 | Molecular Weight | 341.49 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 490.7±45.0 °C at 760 mmHg |
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| Molecular Formula | C22H31NO2 | Melting Point | / |
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| MSDS | / | Flash Point | 233.2±27.4 °C |
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Names
| Name | 2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenol |
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| Synonym | More Synonyms |
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(Rac)-5-Hydroxymethyl Tolterodine BiologicalActivity
| Description | (Rac)-5-Hydroxymethyl Tolterodine ((Rac)-Desfesoterodine), an active metabolite of Tolterodine, is a mAChR antagonist (Ki values of 2.3 nM, 2 nM, 2.5 nM, 2.8 nM, and 2.9 nM for M1, M2, M3, M4, and M5 receptors, respectively). (Rac)-5-Hydroxymethyl Tolterodine can be used for overactive bladder research[1]. |
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| Related Catalog | Signaling Pathways >>Neuronal Signaling >>mAChRSignaling Pathways >>GPCR/G Protein >>mAChRResearch Areas >>Neurological Disease |
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| Target | Ki: M1 (2.3 nM), M2 (2 nM), M3 (2.5 nM), M4 (2.8 nM), and M5 (2.9 nM)[1] |
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| In Vitro | In vitro, (Rac)-5-Hydroxymethyl Tolterodine (PNU-200577) produces a competitive and concentration-dependent inhibition of carbachol-induced contraction of guinea-pig isolated urinary bladder strips (KB of 0.84 nM; pA2 of 9.14)[2]. |
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| In Vivo | (Rac)-5-Hydroxymethyl Tolterodine (5-HMT; 0.88 μmol/kg; i.v.) treatment shows the binding activity of (Rac)-5-Hydroxymethyl Tolterodine to muscarinic receptors is significantly observed in all tissues, except cerebral cortex, with a longer duration in bladder[3]. |
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| References | [1]. L Nilvebrant, et al. Antimuscarinic potency and bladder selectivity of PNU-200577, a major metabolite of tolterodine. Pharmacol Toxicol. 1997 Oct;81(4):169-72. [2]. B Malhotra, et al. The design and development of fesoterodine as a prodrug of 5-hydroxymethyl tolterodine (5-HMT), the active metabolite of tolterodine. Curr Med Chem. 2009;16(33):4481-9. [3]. Shizuo Yamada, et al. Muscarinic receptor binding of fesoterodine, 5-hydroxymethyl tolterodine, and tolterodine in rat tissues after the oral, intravenous, or intravesical administration. J Pharmacol Sci. 2019 May;140(1):73-78. |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 490.7±45.0 °C at 760 mmHg |
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| Molecular Formula | C22H31NO2 |
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| Molecular Weight | 341.49 |
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| Flash Point | 233.2±27.4 °C |
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| Exact Mass | 341.235474 |
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| PSA | 43.70000 |
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| LogP | 4.12 |
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| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
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| Index of Refraction | 1.563 |
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| InChIKey | DUXZAXCGJSBGDW-UHFFFAOYSA-N |
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| SMILES | CC(C)N(CCC(c1ccccc1)c1cc(CO)ccc1O)C(C)C |
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2922509090 |
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Customs
| HS Code | 2922509090 |
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| Summary | 2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| Benzenemethanol, 3-[3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxy- |
| N,N-diisopropyl-3-(2-hydroxy-5-hydroxymethylphenyl)-3-phenylpropylamine |
| RS-N,N-diisopropyl-3-(2-hydroxy-5-(hydroxymethyl)phenyl)-3-phenylpropylamine |
| 2-(3-diisopropylamino-1-phenylpropyl)-4-hydroxymethylphenol |
| 2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol |
| rac 5-Hydroxymethyl Tolterodine |
| feso deacyl raceme |
| (R)-2-[3-(diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol |
| 3-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxybenzenemethanol |
| Fesoterodine fumarate Intermediate 1 |
