N-(3-chlorophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chlorophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K835-0076 |
| Compound Name: | N-(3-chlorophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 458.97 |
| Molecular Formula: | C22 H23 Cl N4 O3 S |
| Smiles: | CC1CCCN(C1)C(CN1C=Nc2c(C1=O)c(C)c(C(Nc1cccc(c1)[Cl])=O)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2726 |
| logD: | 3.2118 |
| logSw: | -3.9997 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.658 |
| InChI Key: | JXXNCCVLNCBKPQ-ZDUSSCGKSA-N |