2-chloro-N-{2-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide

2-chloro-N-{2-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide

Formula: C23H15ClF3N3O2S2

SMILES: FC(F)(F)C1=CC=CC=C1NC(=O)CSC1=NC2=CC=C(NC(=O)C3=CC=CC=C3Cl)C=C2S1

IUPAC: 2-chloro-N-{2-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide

InChI: InChI=1S/C23H15ClF3N3O2S2/c24-16-7-3-1-5-14(16)21(32)28-13-9-10-18-19(11-13)34-22(30-18)33-12-20(31)29-17-8-4-2-6-15(17)23(25,26)27/h1-11H,12H2,(H,28,32)(H,29,31)

Composition: C (52.93%), H (2.90%), Cl (6.79%), F (10.92%), N (8.05%), O (6.13%), S (12.28%)

Molar Mass: 521.96

Atom Count: 49

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	521.0246313
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	UNWBMNVALKHPLG-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	130.18
Topological Polar Surface Area	71.09
Polarizability	48.73
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H15ClF3N3O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00