tert-butyl 6-{4-bromo-6-chloro-1-[(4-fluoro-3,5-dimethylphenyl)methyl]-1,3-benzodiazol-2-yl}-2,6-diazaspiro[3.3]heptane-2-carboxylate, SOS1 agonist-1
HIT218832969
sdf文件结构编辑类似物检索
HIT ID: HIT218832969
Cas No:
分子式: C26H29BrClFN4O2
分子量: 563.9
常用名: tert-butyl 6-{4-bromo-6-chloro-1-[(4-fluoro-3,5-dimethylphenyl)methyl]-1,3-benzodiazol-2-yl}-2,6-diazaspiro[3.3]heptane-2-carboxylate, SOS1 agonist-1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: tert-butyl 6-{4-bromo-6-chloro-1-[(4-fluoro-3,5-dimethylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}-2,6-diazaspiro[3.3]heptane-2-carboxylate
SMILES: Cc1cc(Cn2c(nc3c(Br)cc(Cl)cc23)N2CC3(CN(C3)C(=O)OC(C)(C)C)C2)cc(C)c1F
InChI key: VXKBOSGNBGMADK-UHFFFAOYSA-N
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