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579458-51-8 | Benzo[b]thiophene-2-carboxamide, 3-chloro-N-cyclopentyl-N-[(6-ethoxy-1,2-dihydro-2-oxo-3-quinolinyl)methyl]- (9CI)
CAS No: 579458-51-8 Catalog No: AG00F2QV MDL No:
Product Description
Catalog Number:
AG00F2QV
Chemical Name:
Benzo[b]thiophene-2-carboxamide, 3-chloro-N-cyclopentyl-N-[(6-ethoxy-1,2-dihydro-2-oxo-3-quinolinyl)methyl]- (9CI)
CAS Number:
579458-51-8
IUPAC Name:
3-chloro-N-cyclopentyl-N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-benzothiophene-2-carboxamide
InChI:
InChI=1S/C26H25ClN2O3S/c1-2-32-19-11-12-21-16(14-19)13-17(25(30)28-21)15-29(18-7-3-4-8-18)26(31)24-23(27)20-9-5-6-10-22(20)33-24/h5-6,9-14,18H,2-4,7-8,15H2,1H3,(H,28,30)
InChI Key:
YDMGMFJBSSLWAQ-UHFFFAOYSA-N
Properties
Complexity:
771
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.127g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
481.007g/mol
Monoisotopic Mass:
480.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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