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86750-59-6

86750-59-6 | 4-chloro-N-[1-(4-methylphenyl)sulfonylcyclopropyl]benzamide

CAS No: 86750-59-6 Catalog No: AG004NB4 MDL No:

Product Description

Catalog Number:
AG004NB4
Chemical Name:
4-chloro-N-[1-(4-methylphenyl)sulfonylcyclopropyl]benzamide
CAS Number:
86750-59-6
Molecular Formula:
C17H16ClNO3S
Molecular Weight:
349.8318
IUPAC Name:
4-chloro-N-[1-(4-methylphenyl)sulfonylcyclopropyl]benzamide
InChI:
InChI=1S/C17H16ClNO3S/c1-12-2-8-15(9-3-12)23(21,22)17(10-11-17)19-16(20)13-4-6-14(18)7-5-13/h2-9H,10-11H2,1H3,(H,19,20)
InChI Key:
INFJJNXEAGWNER-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)C1(CC1)NC(=O)c1ccc(cc1)Cl
NSC Number:
378713

Properties

Complexity:
537  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.054g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
349.829g/mol
Monoisotopic Mass:
349.054g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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