ChemDiv1_010723

ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-[(3-cyano-6-thiophen-2-yl-2-pyridinyl)sulfanylmethyl]-4H-pyran-3-carboxylate

Also Known As: ChemDiv1_010723|HMS617H09|AG-205/11316048|A0564/0026067|ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-(((3-cyano-6-(thiophen-2-yl)pyridin-2-yl)thio)methyl)-4H-pyran-3-carboxylate|ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-({[3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-4H-pyran-3-carboxylate|ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-[(3-cyano-6-thiophen-2-ylpyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate|ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-{[(3-cyano-6-thien-2-ylpyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

Molecular Formula	C26H19ClN4O3S2
Molecular Weight	534.0587 g/mol
LogP	5.75236
Topological Polar Surface Area	122.02 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	534.0587
Monoisotopic Mass	534.0587
Heavy Atoms	36
Complexity	1435.3076

Chemical Identifiers

CAS Number	339583-31-2
SMILES	CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)Cl)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N