1-(4-chlorophenyl)-3-(4-methylbenzenesulfonyl)urea

1-(4-chlorophenyl)-3-(4-methylbenzenesulfonyl)urea

CAS: 3955-50-8

Formula: C14H13ClN2O3S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC1=CC=C(Cl)C=C1

IUPAC: 1-(4-chlorophenyl)-3-(4-methylbenzenesulfonyl)urea

InChI: InChI=1S/C14H13ClN2O3S/c1-10-2-8-13(9-3-10)21(19,20)17-14(18)16-12-6-4-11(15)5-7-12/h2-9H,1H3,(H2,16,17,18)

Composition: C (51.77%), H (4.03%), Cl (10.92%), N (8.63%), O (14.78%), S (9.87%)

Molar Mass: 324.78

Atom Count: 34

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	324.0335412
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YOIDHZBOHMNTNP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.76
Topological Polar Surface Area	75.27
Polarizability	31.91
Ring Count	2
Rotatable Bond Count	2

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