5-(4-chlorobenzenesulfinyl)-N-ethyl-1,2,3-thiadiazole-4-carboxamide

5-(4-chlorobenzenesulfinyl)-N-ethyl-1,2,3-thiadiazole-4-carboxamide

CAS: 306977-05-9

Formula: C11H10ClN3O2S2

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

IUPAC: 5-(4-chlorobenzenesulfinyl)-N-ethyl-1,2,3-thiadiazole-4-carboxamide

InChI: InChI=1/C11H10ClN3O2S2/c1-2-13-10(16)9-11(18-15-14-9)19(17)8-5-3-7(12)4-6-8/h3-6H,2H2,1H3,(H,13,16)

Composition: C (41.84%), H (3.19%), Cl (11.23%), N (13.31%), O (10.13%), S (20.30%)

Molar Mass: 315.79

Atom Count: 29

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	314.9902966
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PXAJDEFCXIEJBV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.73
Topological Polar Surface Area	71.95
Polarizability	29.17
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	306977-05-9		$51.35-$86.31$51.35$63.37$86.31