ethyl 4-(2-{[4-oxo-6-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[4-oxo-6-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[4-oxo-6-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | E140-0293 |
| Compound Name: | ethyl 4-(2-{[4-oxo-6-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C26 H28 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1NC(C2CN(CCC=2N=1)CCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3675 |
| logD: | 2.8181 |
| logSw: | -3.4959 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.827 |
| InChI Key: | SQHDFBVUWCISQF-UHFFFAOYSA-N |