5-(4-chlorobenzenesulfonyl)-4-methyl-1,2,3-thiadiazole

5-(4-chlorobenzenesulfonyl)-4-methyl-1,2,3-thiadiazole

CAS: 339008-83-2

Formula: C9H7ClN2O2S2

SMILES: CC1=C(SN=N1)S(=O)(=O)C1=CC=C(Cl)C=C1

IUPAC: 5-(4-chlorobenzenesulfonyl)-4-methyl-1,2,3-thiadiazole

InChI: InChI=1S/C9H7ClN2O2S2/c1-6-9(15-12-11-6)16(13,14)8-4-2-7(10)3-5-8/h2-5H,1H3

Composition: C (39.35%), H (2.57%), Cl (12.90%), N (10.20%), O (11.65%), S (23.34%)

Molar Mass: 274.74

Atom Count: 23

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	273.9637475
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	MYMMXLMFDKFSJX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.44
Topological Polar Surface Area	59.92
Polarizability	25.11
Ring Count	2
Rotatable Bond Count	2

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