ethyl 1-{[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
ethyl 1-{[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V021-3264 |
| Compound Name: | ethyl 1-{[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)CC1NC(c2c(csc2N=1)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.594 |
| logD: | 3.5788 |
| logSw: | -3.8524 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.289 |
| InChI Key: | PAMDOZLAHFKGNV-UHFFFAOYSA-N |