ethyl 4-[2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
ethyl 4-[2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | E140-0213 |
| Compound Name: | ethyl 4-[2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 496.56 |
| Molecular Formula: | C25 H25 F N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1NC(C2CN(CCC=2N=1)Cc1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1637 |
| logD: | 2.6142 |
| logSw: | -3.3715 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.849 |
| InChI Key: | ULMOTVCWAYQKEI-UHFFFAOYSA-N |