N-(3-chloro-4-fluorophenyl)-3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-fluorophenyl)-3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K895-0018 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 490.98 |
| Molecular Formula: | C23 H24 Cl F N4 O3 S |
| Smiles: | CC1CC(C)CN(C1)C(CN1C=Nc2c(C1=O)c(C)c(C(Nc1ccc(c(c1)[Cl])F)=O)s2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7977 |
| logD: | 2.7802 |
| logSw: | -4.5157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.592 |
| InChI Key: | WGNSVNXDWDTEDV-UHFFFAOYSA-N |