化合物产品

Danirixin

CAS 登记号954126-98-8

CAS: 954126-98-8
PubChem CID: 24780598
SMILES: CC1=C(C=CC=C1F)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)[C@H]3CCCNC3)O
分子式: C19H21ClFN3O4S
分子量: 441.912
精确分子量: 441.0925
InChI: InChI=1S/C19H21ClFN3O4S/c1-11-14(21)5-2-6-15(11)23-19(26)24-16-8-7-13(20)18(17(16)25)29(27,28)12-4-3-9-22-10-12/h2,5-8,12,22,25H,3-4,9-10H2,1H3,(H2,23,24,26)/t12-/m0/s1
InChIKey: NGYNBSHYFOFVLS-LBPRGKRZSA-N
LogP: 3.6628
TPSA: 107.53

名称与别名