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119514-97-5 | Benzamide, N-[(4-methylphenyl)sulfonyl]-3-(2-quinolinylmethoxy)-
CAS No: 119514-97-5 Catalog No: AG000IX4 MDL No:
Product Description
Catalog Number:
AG000IX4
Chemical Name:
Benzamide, N-[(4-methylphenyl)sulfonyl]-3-(2-quinolinylmethoxy)-
CAS Number:
119514-97-5
Molecular Formula:
C24H20N2O4S
Molecular Weight:
432.4916
IUPAC Name:
N-(4-methylphenyl)sulfonyl-3-(quinolin-2-ylmethoxy)benzamide
InChI:
InChI=1S/C24H20N2O4S/c1-17-9-13-22(14-10-17)31(28,29)26-24(27)19-6-4-7-21(15-19)30-16-20-12-11-18-5-2-3-8-23(18)25-20/h2-15H,16H2,1H3,(H,26,27)
InChI Key:
RQFQHHZDINZMGC-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NC(=O)c1cccc(c1)OCc1ccc2c(n1)cccc2
Properties
Complexity:
699
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.114g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
432.494g/mol
Monoisotopic Mass:
432.114g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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