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7065-76-1 | 6-[(5-chloro-2-methyl-phenyl)amino]-N,N-dipropan-2-yl-pyridine-3-sulfonamide
CAS No: 7065-76-1 Catalog No: AG005H6R MDL No:
Product Description
Catalog Number:
AG005H6R
Chemical Name:
6-[(5-chloro-2-methyl-phenyl)amino]-N,N-dipropan-2-yl-pyridine-3-sulfonamide
CAS Number:
7065-76-1
Molecular Formula:
C18H24ClN3O2S
Molecular Weight:
381.9201
IUPAC Name:
6-(5-chloro-2-methylanilino)-N,N-di(propan-2-yl)pyridine-3-sulfonamide
InChI:
InChI=1S/C18H24ClN3O2S/c1-12(2)22(13(3)4)25(23,24)16-8-9-18(20-11-16)21-17-10-15(19)7-6-14(17)5/h6-13H,1-5H3,(H,20,21)
InChI Key:
KOAJCOFMVFUAJL-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Nc1ccc(cn1)S(=O)(=O)N(C(C)C)C(C)C)C
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.128g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
381.919g/mol
Monoisotopic Mass:
381.128g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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