2-[(4-chlorophenyl)methyl]-N-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxamide

2-[(4-chlorophenyl)methyl]-N-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxamide

CAS: 478030-43-2

Formula: C17H11Cl3N2OS

SMILES: ClC1=CC=C(CC2=NC(=CS2)C(=O)NC2=CC(Cl)=CC(Cl)=C2)C=C1

IUPAC: 2-[(4-chlorophenyl)methyl]-N-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxamide

InChI: InChI=1S/C17H11Cl3N2OS/c18-11-3-1-10(2-4-11)5-16-22-15(9-24-16)17(23)21-14-7-12(19)6-13(20)8-14/h1-4,6-9H,5H2,(H,21,23)

Composition: C (51.34%), H (2.79%), Cl (26.74%), N (7.04%), O (4.02%), S (8.06%)

Molar Mass: 397.7

Atom Count: 35

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	395.9657673
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PRKXNVQDPXDJEZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	100
Topological Polar Surface Area	41.99
Polarizability	37.77
Ring Count	3
Rotatable Bond Count	4

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90%	<2 Days	478030-43-2		$51.35-$86.31$51.35$63.37$86.31