3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanoic acid
Chemical Structure Depiction of
3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanoic acid
3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanoic acid
Compound characteristics
| Compound ID: | 0622-0129 |
| Compound Name: | 3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanoic acid |
| Molecular Weight: | 278.33 |
| Molecular Formula: | C13 H14 N2 O3 S |
| Smiles: | C1CCc2c(C1)c1C(NC(CCC(O)=O)=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6767 |
| logD: | -1.1458 |
| logSw: | -2.2226 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.379 |
| InChI Key: | ZUYIZUTYDFCUMM-UHFFFAOYSA-N |