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339102-38-4 | 4-methoxy-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-phenylbenzene-1-sulfonamide
CAS No: 339102-38-4 Catalog No: AG00IVRU MDL No:MFCD00665367
Product Description
Catalog Number:
AG00IVRU
Chemical Name:
4-methoxy-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-N-phenylbenzene-1-sulfonamide
CAS Number:
339102-38-4
Molecular Formula:
C19H22N2O4S
Molecular Weight:
374.4540
MDL Number:
MFCD00665367
IUPAC Name:
4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)-N-phenylbenzenesulfonamide
InChI:
InChI=1S/C19H22N2O4S/c1-25-17-9-11-18(12-10-17)26(23,24)21(16-7-3-2-4-8-16)15-19(22)20-13-5-6-14-20/h2-4,7-12H,5-6,13-15H2,1H3
InChI Key:
BVCRFQGELGVFBV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)N(c1ccccc1)CC(=O)N1CCCC1
Properties
Complexity:
555
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.13g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.455g/mol
Monoisotopic Mass:
374.13g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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