3-benzyl-2-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
3-benzyl-2-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | E580-0016 |
| Compound Name: | 3-benzyl-2-{[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 491.67 |
| Molecular Formula: | C27 H29 N3 O2 S2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(CSC1=NC2CCSC=2C(N1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7479 |
| logD: | 4.7479 |
| logSw: | -4.7175 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.229 |
| InChI Key: | TZDXUQKJAVTNFT-UHFFFAOYSA-N |