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79817-49-5 | Acetamide,N-[4-[[(4-chloro-3-nitrophenyl)sulfonyl]amino]phenyl]-
CAS No: 79817-49-5 Catalog No: AG005H8E MDL No:
Product Description
Catalog Number:
AG005H8E
Chemical Name:
Acetamide,N-[4-[[(4-chloro-3-nitrophenyl)sulfonyl]amino]phenyl]-
CAS Number:
79817-49-5
Molecular Formula:
C14H12ClN3O5S
Molecular Weight:
369.7802
IUPAC Name:
N-[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]acetamide
InChI:
InChI=1S/C14H12ClN3O5S/c1-9(19)16-10-2-4-11(5-3-10)17-24(22,23)12-6-7-13(15)14(8-12)18(20)21/h2-8,17H,1H3,(H,16,19)
InChI Key:
FAGBGCWSFWSOHI-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
EC Number:
279-279-8
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.019g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
369.776g/mol
Monoisotopic Mass:
369.019g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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