3-[(2-chlorophenyl)methyl]-2-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-2-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-[(2-chlorophenyl)methyl]-2-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-4365 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-2-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 448 |
| Molecular Formula: | C21 H22 Cl N3 O2 S2 |
| Smiles: | CC1CCCN(C1)C(CSC1=Nc2ccsc2C(N1Cc1ccccc1[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5002 |
| logD: | 4.5002 |
| logSw: | -4.4297 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.115 |
| InChI Key: | QCELYOSLZFKPAR-AWEZNQCLSA-N |