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1005301-95-0 | BENZENESULFONAMIDE, N-[1-(2-FURANYLCARBONYL)-1,2,3,4-TETRAHYDRO-7-QUINOLINYL]-2,4-DIMETHYL-
CAS No: 1005301-95-0 Catalog No: AG00029N MDL No:
Product Description
Catalog Number:
AG00029N
Chemical Name:
BENZENESULFONAMIDE, N-[1-(2-FURANYLCARBONYL)-1,2,3,4-TETRAHYDRO-7-QUINOLINYL]-2,4-DIMETHYL-
CAS Number:
1005301-95-0
Molecular Formula:
C22H22N2O4S
Molecular Weight:
410.4861
IUPAC Name:
N-[1-(furan-2-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2,4-dimethylbenzenesulfonamide
InChI:
InChI=1S/C22H22N2O4S/c1-15-7-10-21(16(2)13-15)29(26,27)23-18-9-8-17-5-3-11-24(19(17)14-18)22(25)20-6-4-12-28-20/h4,6-10,12-14,23H,3,5,11H2,1-2H3
InChI Key:
JQJHIZAQHUGWCI-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)S(=O)(=O)Nc1ccc2c(c1)N(CCC2)C(=O)c1ccco1
Properties
Complexity:
691
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.13g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
410.488g/mol
Monoisotopic Mass:
410.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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