N-(3-chloro-4-fluorophenyl)-2-{2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetamide
Compound characteristics
| Compound ID: | Y021-3469 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetamide |
| Molecular Weight: | 452.93 |
| Molecular Formula: | C20 H22 Cl F N4 O3 S |
| Smiles: | CC(C)CCSC1NC2=C(CC(CC(Nc3ccc(c(c3)[Cl])F)=O)C(N2)=O)C(N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.228 |
| logD: | 0.6617 |
| logSw: | -3.5518 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.346 |
| InChI Key: | JZOWTDQVNOBCDS-LLVKDONJSA-N |