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36287-50-0 | 3-METHYL-4-(2-OXO-4-PHENYL-1-PYRROLIDINYL)BENZENESULFONAMIDE
CAS No: 36287-50-0 Catalog No: AG007A7B MDL No:
Product Description
Catalog Number:
AG007A7B
Chemical Name:
3-METHYL-4-(2-OXO-4-PHENYL-1-PYRROLIDINYL)BENZENESULFONAMIDE
CAS Number:
36287-50-0
Molecular Formula:
C17H18N2O3S
Molecular Weight:
330.4014
IUPAC Name:
3-methyl-4-(2-oxo-4-phenylpyrrolidin-1-yl)benzenesulfonamide
InChI:
InChI=1S/C17H18N2O3S/c1-12-9-15(23(18,21)22)7-8-16(12)19-11-14(10-17(19)20)13-5-3-2-4-6-13/h2-9,14H,10-11H2,1H3,(H2,18,21,22)
InChI Key:
OTUMEMFZQZQKRN-UHFFFAOYSA-N
SMILES:
O=C1CC(CN1c1ccc(cc1C)S(=O)(=O)N)c1ccccc1
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.104g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.402g/mol
Monoisotopic Mass:
330.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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