Introduction：Basic information about CAS 157254-60-9|1,4-PBIT DIHYDROBROMIDE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,4-PBIT DIHYDROBROMIDE |
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| CAS Number | 157254-60-9 | Molecular Weight | 444.25 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C12H20Br2N4S2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 2-[4-(2-carbamimidoylsulfanylethyl)phenyl]ethyl carbamimidothioate,dihydrobromide |
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| Synonym | More Synonyms |
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1,4-PBIT DIHYDROBROMIDE BiologicalActivity
| Description | 1,4-PBIT (1,4-PB-ITU) dihydrobromide (compound 46) is a potent nitric oxide synthases (NOS) inhibitor, with Ki values of 7.6 nM, 360 nM, and 16 nM for the inducible (iNOS), endothelial (eNOS), and neuronal (nNOS) isozymes, respectively[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Immunology/Inflammation >>NO Synthase |
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| Target | iNOS:7.6 nM (Ki) eNOS:360 nM (Ki) nNOS:16 nM (Ki) |
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| References | [1]. E P Garvey, et al. Potent and selective inhibition of human nitric oxide synthases. Inhibition by non-amino acid isothioureas. J Biol Chem. 1994 Oct 28;269(43):26669-76. |
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Chemical & Physical Properties
| Molecular Formula | C12H20Br2N4S2 |
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| Molecular Weight | 444.25 |
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| Exact Mass | 441.949585 |
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| PSA | 150.34000 |
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| LogP | 5.54120 |
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| InChIKey | YRRYHMLYGVNPBW-UHFFFAOYSA-N |
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| SMILES | Br.Br.N=C(N)SCCc1ccc(CCSC(=N)N)cc1 |
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Safety Information
Synonyms
| 1,4-Phenylenedi-2,1-ethanediyl dicarbamimidothioate dihydrobromide |
| 1,4-PB-ITU dihydrobromide |
| Carbamimidothioic acid, 1,4-phenylenedi-2,1-ethanediyl ester, hydrobromide (1:2) |
| 1,4-Phenylenediethane-2,1-diyl dicarbamimidothioate dihydrobromide |
| 1,4-PBIT dihydrobromide |
