N-phenyl-2-[(phenylcarbamothioyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

N-phenyl-2-[(phenylcarbamothioyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

Formula: C21H19N3OS2

SMILES: O=C(NC1=CC=CC=C1)C1=C(NC(=S)NC2=CC=CC=C2)SC2=C1CCC2

IUPAC: N-phenyl-2-[(phenylcarbamothioyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

InChI: InChI=1S/C21H19N3OS2/c25-19(22-14-8-3-1-4-9-14)18-16-12-7-13-17(16)27-20(18)24-21(26)23-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,22,25)(H2,23,24,26)

Composition: C (64.10%), H (4.87%), N (10.68%), O (4.07%), S (16.29%)

Molar Mass: 393.52

Atom Count: 46

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	393.096954592
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	3
InChIKey	ZLSJZMWLDVUUNP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	118.66
Topological Polar Surface Area	53.16
Polarizability	43.38
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H19N3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00