化合物产品

Erismodegib

CAS 登记号956697-53-3

CAS: 956697-53-3
PubChem CID: 24775005
SMILES: C[C@@H]1CN(C[C@@H](O1)C)C2=NC=C(C=C2)NC(=O)C3=CC=CC(=C3C)C4=CC=C(C=C4)OC(F)(F)F
分子式: C26H26F3N3O3
分子量: 485.506
精确分子量: 485.1926
InChI: InChI=1S/C26H26F3N3O3/c1-16-14-32(15-17(2)34-16)24-12-9-20(13-30-24)31-25(33)23-6-4-5-22(18(23)3)19-7-10-21(11-8-19)35-26(27,28)29/h4-13,16-17H,14-15H2,1-3H3,(H,31,33)/t16-,17+
InChIKey: VZZJRYRQSPEMTK-CALCHBBNSA-N
LogP: 5.8215
TPSA: 63.69

名称与别名