AC1N8YCP
ethyl 6-amino-2-[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-yl-2-pyridinyl]sulfanylmethyl]-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate
Also Known As: SS-0899|KS-00003S85|AK-777/36976011|ethyl 6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-5-cyano-4-(pyridin-3-yl)-4H-pyran-3-carboxylate|ethyl 6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(2-thienyl)-2-pyridinyl]sulfanyl}methyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate|ethyl 6-amino-2-[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-ylpyridin-2-yl]sulfanylmethyl]-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate|ethyl 6-amino-2-(((4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl)thio)methyl)-5-cyano-4-(pyridin-3-yl)-4H-pyran-3-carboxylate|ethyl 6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(2-thienyl)-2-pyridinyl]sulfanyl}methyl)-5-cyano-4-(3-pyridinyl)-4H-pyra|ethyl6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-5-cyano-4-(pyridin-3-yl)-4H-pyran-3-carboxylate
| Molecular Formula | C31H22ClN5O3S2 |
|---|---|
| Molecular Weight | 611.08527 g/mol |
| LogP | 6.81436 |
| Topological Polar Surface Area | 134.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 611.08527 |
| Monoisotopic Mass | 611.08527 |
| Heavy Atoms | 42 |
| Complexity | 1774.222 |
Chemical Identifiers
| CAS Number | 316357-73-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C(C1C2=CN=CC=C2)C#N)N)CSC3=C(C(=CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)Cl)C#N |
Product Overview
AC1N8YCP (CAS 316357-73-0), with molecular formula C31H22ClN5O3S2 and molecular weight 611.08527 g/mol. IUPAC: ethyl 6-amino-2-[[4-(4-chlorophenyl)-3-cyano-6-thiophen-2-yl-2-pyridinyl]sulfanylmethyl]-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate.