N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-2645 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 583.07 |
| Molecular Formula: | C27 H27 Cl N6 O5 S |
| Smiles: | Cc1c2C(N(CC(N3CCN(CC3)c3ccccn3)=O)C=Nc2sc1C(Nc1cc(c(cc1OC)OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9522 |
| logD: | 1.9588 |
| logSw: | -3.691 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.06 |
| InChI Key: | AGQVXICNAFRYTC-UHFFFAOYSA-N |