N-(3,5-dichlorophenyl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide

N-(3,5-dichlorophenyl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide

CAS: 477857-84-4

Formula: C15H9Cl2N3OS

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

IUPAC: N-(3,5-dichlorophenyl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide

InChI: InChI=1S/C15H9Cl2N3OS/c16-10-6-11(17)8-12(7-10)18-15(21)14-13(19-20-22-14)9-4-2-1-3-5-9/h1-8H,(H,18,21)

Composition: C (51.44%), H (2.59%), Cl (20.24%), N (12.00%), O (4.57%), S (9.15%)

Molar Mass: 350.22

Atom Count: 31

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	348.9843385
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KBJLEVFQQSVKEO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	90.05
Topological Polar Surface Area	54.88
Polarizability	34.6
Ring Count	3
Rotatable Bond Count	3

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