2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide

2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide

Formula: C18H16N4OS2

SMILES: O=C(CSC1=NC2=CC=CC=C2N1)NC1=C(C#N)C2=C(CCCC2)S1

IUPAC: 2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide

InChI: InChI=1S/C18H16N4OS2/c19-9-12-11-5-1-4-8-15(11)25-17(12)22-16(23)10-24-18-20-13-6-2-3-7-14(13)21-18/h2-3,6-7H,1,4-5,8,10H2,(H,20,21)(H,22,23)

Composition: C (58.67%), H (4.38%), N (15.21%), O (4.34%), S (17.40%)

Molar Mass: 368.47

Atom Count: 41

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	368.076553499
Formal Charge	0
FSP3	0.28
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BPXMTPRPTLGVEY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.12
Topological Polar Surface Area	81.57
Polarizability	39.16
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H16N4OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00