2-[(benzenesulfonyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(benzenesulfonyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[(benzenesulfonyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8576-1247 |
| Compound Name: | 2-[(benzenesulfonyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 360.45 |
| Molecular Formula: | C17 H16 N2 O3 S2 |
| Smiles: | C1CCc2c(C1)c1C(NC(CS(c3ccccc3)(=O)=O)=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6725 |
| logD: | 2.6718 |
| logSw: | -3.1954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.76 |
| InChI Key: | IJBRUYLQHDBFPF-UHFFFAOYSA-N |