(S)-1-(6,7-Dihydro-5H-Benzo[6,7]Cyclohepta[1,2-C]Pyridazin-3-Yl)-N3-(7-(Pyrrolidin-1-Yl)-6,7,8,9-Tetrahydro-5H-Benzo[7]Annulen-2-Yl)-1H-1,2,4-Triazole-3,5-Diamine (S)-1-(6,7-二氢-5H-苯并[6,7]环庚并[1,2-c]哒嗪-3-基)-N3-(7-(吡咯烷-1-基)-6,7,8,9-四氢-5H-苯并[7]环庚烯-2-基)-1H-1,2,4-三唑-3,5-二胺
CAS 1037624-75-1 MFCD137624751
化学结构图
SMILES:
化学属性
| Mol. Formula | C30H34N8 |
|---|---|
| Mol. Weight | 506.64 |
| Appearance | Solid powder |
| Solubility | Soluble in DMSO, not in water |
别名和识别编码
| Chemical Name | (S)-1-(6,7-Dihydro-5H-Benzo[6,7]Cyclohepta[1,2-C]Pyridazin-3-Yl)-N3-(7-(Pyrrolidin-1-Yl)-6,7,8,9-Tetrahydro-5H-Benzo[7]Annulen-2-Yl)-1H-1,2,4-Triazole-3,5-Diamine |
|---|---|
| Chemical Name Translation | (S)-1-(6,7-二氢-5H-苯并[6,7]环庚并[1,2-c]哒嗪-3-基)-N3-(7-(吡咯烷-1-基)-6,7,8,9-四氢-5H-苯并[7]环庚烯-2-基)-1H-1,2,4-三唑-3,5-二胺 |
| Chemicalbook ID | CB42621146 |
| Formula | C30H34N8 |
| Synonym | BGB324; BGB-324; BGB 324; R 428; R-428; R428; Bemcentinib |
| IUPAC Name | (S)-1-(6,7-dihydro-5H-benzo[6,7]cyclohepta[1,2-c]pyridazin-3-yl)-N3-(7-(pyrrolidin-1-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl)-1H-1,2,4-triazole-3,5-diamine |
| InChIKey | KXMZDGSRSGHMMK-VWLOTQADSA-N |
| InChI | InChI=1S/C30H34N8/c31-29-33-30(32-24-13-10-20-11-14-25(15-12-22(20)18-24)37-16-3-4-17-37)36-38(29)27-19-23-8-5-7-21-6-1-2-9-26(21)28(23)35-34-27/h1-2,6,9-10,13,18-19,25H,3-5,7-8,11-12,14-17H2,(H3,31,32,33,36)/t25-/m0/s1 |
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产品应用
- Bemcentinib, also known as BGB-324 or R428, is a selective small molecule inhibitor of Axl kinase, which showed activity to blocks tumor spread and prolongs survival in models of metastatic breast cancer. The receptor tyrosine kinase Axl may play an important role in cancer progression, invasion, metastasis, drug resistance, and patient mortality. R428 inhibits Axl with low nanomolar activity and blocked Axl-dependent events, including Akt phosphorylation, breast cancer cell invasion, and proinflammatory cytokine production.
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