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116-42-7 | Benzamide, N-[(4-aminophenyl)sulfonyl]-4-(1-methylethoxy)-
CAS No: 116-42-7 Catalog No: AG000BCR MDL No:
Product Description
Catalog Number:
AG000BCR
Chemical Name:
Benzamide, N-[(4-aminophenyl)sulfonyl]-4-(1-methylethoxy)-
CAS Number:
116-42-7
Molecular Formula:
C16H18N2O4S
Molecular Weight:
334.3901
IUPAC Name:
N-(4-aminophenyl)sulfonyl-4-propan-2-yloxybenzamide
InChI:
InChI=1S/C16H18N2O4S/c1-11(2)22-14-7-3-12(4-8-14)16(19)18-23(20,21)15-9-5-13(17)6-10-15/h3-11H,17H2,1-2H3,(H,18,19)
InChI Key:
FBFBRAFXKGRRHI-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(cc1)N)C
EC Number:
204-140-5
UNII:
YR841R53VW
NSC Number:
120646
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.099g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
334.39g/mol
Monoisotopic Mass:
334.099g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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