化合物产品

Zanubrutinib

CAS 登记号1691249-45-2

CAS: 1691249-45-2
PubChem CID: 135565884
SMILES: C=CC(=O)N1CCC(CC1)[C@@H]2CCNC3=C(C(=NN23)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=O)N
分子式: C27H29N5O3
分子量: 471.561
精确分子量: 471.227
InChI: InChI=1S/C27H29N5O3/c1-2-23(33)31-16-13-18(14-17-31)22-12-15-29-27-24(26(28)34)25(30-32(22)27)19-8-10-21(11-9-19)35-20-6-4-3-5-7-20/h2-11,18,22,29H,1,12-17H2,(H2,28,34)/t22-/m0/s1
InChIKey: RNOAOAWBMHREKO-QFIPXVFZSA-N
LogP: 4.2226
TPSA: 102.48

名称与别名