2-({6-[(E)-[(4-chlorophenyl)methylidene]amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide

2-({6-[(E)-[(4-chlorophenyl)methylidene]amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide

Formula: C24H20ClN3OS2

SMILES: ClC1=CC=C(C=NC2=CC=C3N=C(SCC(=O)NCCC4=CC=CC=C4)SC3=C2)C=C1

IUPAC: 2-({6-[(E)-[(4-chlorophenyl)methylidene]amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenylethyl)acetamide

InChI: InChI=1S/C24H20ClN3OS2/c25-19-8-6-18(7-9-19)15-27-20-10-11-21-22(14-20)31-24(28-21)30-16-23(29)26-13-12-17-4-2-1-3-5-17/h1-11,14-15H,12-13,16H2,(H,26,29)/b27-15+

Composition: C (61.86%), H (4.33%), Cl (7.61%), N (9.02%), O (3.43%), S (13.76%)

Molar Mass: 466.01

Atom Count: 51

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	465.0736323
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	VNIJHEUQPKDDNE-JFLMPSFJSA-N
Lipinski's Rule of Five
Molar Refractivity	131.81
Topological Polar Surface Area	54.35
Polarizability	50.87
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H20ClN3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00