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827576-79-4 | Propanamide, 3-amino-N-[4-[[(2-benzoylphenyl)amino]sulfonyl]phenyl]-
CAS No: 827576-79-4 Catalog No: AG004Z1D MDL No:
Product Description
Catalog Number:
AG004Z1D
Chemical Name:
Propanamide, 3-amino-N-[4-[[(2-benzoylphenyl)amino]sulfonyl]phenyl]-
CAS Number:
827576-79-4
Molecular Formula:
C22H21N3O4S
Molecular Weight:
423.4848
IUPAC Name:
3-amino-N-[4-[(2-benzoylphenyl)sulfamoyl]phenyl]propanamide
InChI:
InChI=1S/C22H21N3O4S/c23-15-14-21(26)24-17-10-12-18(13-11-17)30(28,29)25-20-9-5-4-8-19(20)22(27)16-6-2-1-3-7-16/h1-13,25H,14-15,23H2,(H,24,26)
InChI Key:
OIZPSQBMJUCONV-UHFFFAOYSA-N
SMILES:
NCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)c1ccccc1
Properties
Complexity:
677
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.125g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
423.487g/mol
Monoisotopic Mass:
423.125g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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