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

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

CAS: 444791-18-8

Formula: C9H6Cl2N2O2S2

SMILES: ClC1=NSC(=N1)S(=O)(=O)CC1=CC(Cl)=CC=C1

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

InChI: InChI=1S/C9H6Cl2N2O2S2/c10-7-3-1-2-6(4-7)5-17(14,15)9-12-8(11)13-16-9/h1-4H,5H2

Composition: C (34.96%), H (1.96%), Cl (22.93%), N (9.06%), O (10.35%), S (20.74%)

Molar Mass: 309.18

Atom Count: 23

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	307.9247752
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	JFKXGMTXATUHTG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.39
Topological Polar Surface Area	59.92
Polarizability	26.97
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	444791-18-8		$2,200.00-$4,180.00$2,200.00$3,190.00$4,180.00