Introduction：Basic information about CAS 1313874-96-2|Afatinib-d6, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Afatinib-d6 |
|---|
| CAS Number | 1313874-96-2 | Molecular Weight | 491.97500 |
|---|
| Density | / | Boiling Point | / |
|---|
| Molecular Formula | C24H19D6ClFN5O3 | Melting Point | / |
|---|
| MSDS | / | Flash Point | / |
|---|
Names
| Name | Afatinib D6 |
|---|
| Synonym | More Synonyms |
|---|
Afatinib-d6 BiologicalActivity
| Description | Afatinib D6 (BIBW 2992 D6) is deuterium labeled Afatinib. Afatinib (BIBW 2992) is an irreversible EGFR family inhibitor[1]. |
|---|
| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
|---|
| Target | EGFR[1] |
|---|
| References | [1]. Li D, et al. BIBW2992, an irreversible EGFR/HER2 inhibitor highly effective in preclinical lung cancer models. Oncogene. 2008 Aug 7;27(34):4702-11. |
|---|
Chemical & Physical Properties
| Molecular Formula | C24H19D6ClFN5O3 |
|---|
| Molecular Weight | 491.97500 |
|---|
| Exact Mass | 491.20100 |
|---|
| PSA | 88.61000 |
|---|
| LogP | 4.53590 |
|---|
| InChIKey | ULXXDDBFHOBEHA-VCXSEIMGSA-N |
|---|
| SMILES | CN(C)CC=CC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OC1CCOC1 |
|---|
| Storage condition | -20C |
|---|
Synonyms
| (S,E)-4-(bis(trideuteromethyl)amino)-N-(4-((3-chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)but-2-enamide |
