6-{[(2-chlorophenyl)methyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

6-{[(2-chlorophenyl)methyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

Formula: C25H20ClN3O2S

SMILES: CC1=C(C(C2=CC=CO2)C(C#N)=C(N1)SCC1=CC=CC=C1Cl)C(=O)NC1=CC=CC=C1

IUPAC: 6-{[(2-chlorophenyl)methyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

InChI: InChI=1/C25H20ClN3O2S/c1-16-22(24(30)29-18-9-3-2-4-10-18)23(21-12-7-13-31-21)19(14-27)25(28-16)32-15-17-8-5-6-11-20(17)26/h2-13,23,28H,15H2,1H3,(H,29,30)

Composition: C (65.00%), H (4.36%), Cl (7.67%), N (9.10%), O (6.93%), S (6.94%)

Molar Mass: 461.96

Atom Count: 52

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	461.0964758
Formal Charge	0
FSP3	0.12
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	OIVDHCMKTYFQHX-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	140.73
Topological Polar Surface Area	78.06
Polarizability	48.86
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H20ClN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00