ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-{[(3-methylquinoxalin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-{[(3-methylquinoxalin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-{[(3-methylquinoxalin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 7287-1022 |
| Compound Name: | ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-{[(3-methylquinoxalin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate |
| Molecular Weight: | 476.53 |
| Molecular Formula: | C25 H21 F N4 O3 S |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1CSc1c(C)nc2ccccc2n1)c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6915 |
| logD: | 4.6915 |
| logSw: | -4.6225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.01 |
| InChI Key: | QJJYUIPCQRQZRH-NRFANRHFSA-N |