579453-74-0
3-CHLORO-N-CYCLOPENTYL-N-[(1,2-DIHYDRO-5,7-DIMETHYL-2-OXO-3-QUINOLINYL)METHYL]-BENZO[B]THIOPHENE-2-CARBOXAMIDE
Name
3-CHLORO-N-CYCLOPENTYL-N-[(1,2-DIHYDRO-5,7-DIMETHYL-2-OXO-3-QUINOLINYL)METHYL]-BENZO[B]THIOPHENE-2-CARBOXAMIDE
Formula
C26 H25 Cl N2 O2 S
MolWeight
465.014
1Identification
【Name】
3-CHLORO-N-CYCLOPENTYL-N-[(1,2-DIHYDRO-5,7-DIMETHYL-2-OXO-3-QUINOLINYL)METHYL]-BENZO[B]THIOPHENE-2-CARBOXAMIDE
【CAS】
【MDL】
MFCD03740426
【English Synonyms】
【Formula】
C26 H25 Cl N2 O2 S
【MolWeight】
465.014
【Inchi】
InChI=1S/C26H25ClN2O2S/c1-15-11-16(2)20-13-17(25(30)28-21(20)12-15)14-29(18-7-3-4-8-18)26(31)24-23(27)19-9-5-6-10-22(19)32-24/h5-6,9-13,18H,3-4,7-8,14H2,1-2H3,(H,28,30)
【InChIKey】
InChIKey=HUAIUWCAODBNHV-UHFFFAOYSA-N
【SMILES】
Cc1cc(c2cc(c(=O)[nH]c2c1)CN(C3CCCC3)C(=O)c4c(c5ccccc5s4)Cl)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:6.0
Bulk/Fine:F