5-[(2-chlorophenyl)methanesulfonyl]-4-phenyl-1,2,3-thiadiazole

5-[(2-chlorophenyl)methanesulfonyl]-4-phenyl-1,2,3-thiadiazole

CAS: 338398-52-0

Formula: C15H11ClN2O2S2

SMILES: ClC1=C(CS(=O)(=O)C2=C(N=NS2)C2=CC=CC=C2)C=CC=C1

IUPAC: 5-[(2-chlorophenyl)methanesulfonyl]-4-phenyl-1,2,3-thiadiazole

InChI: InChI=1S/C15H11ClN2O2S2/c16-13-9-5-4-8-12(13)10-22(19,20)15-14(17-18-21-15)11-6-2-1-3-7-11/h1-9H,10H2

Composition: C (51.35%), H (3.16%), Cl (10.10%), N (7.98%), O (9.12%), S (18.28%)

Molar Mass: 350.84

Atom Count: 33

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	349.9950477
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	IDMCNDQECGQGCB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.62
Topological Polar Surface Area	59.92
Polarizability	35.7
Ring Count	3
Rotatable Bond Count	4

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