ethyl 1-{[5-(2-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{[5-(2-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
ethyl 1-{[5-(2-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]methyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V018-9670 |
| Compound Name: | ethyl 1-{[5-(2-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)c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.279 |
| logD: | 3.2638 |
| logSw: | -3.5822 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.289 |
| InChI Key: | XKCNSWYXTMRFRF-UHFFFAOYSA-N |