N-(4-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-(4-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
N-(4-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K263-0795 |
| Compound Name: | N-(4-methylcyclohexyl)-3-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)propanamide |
| Molecular Weight: | 401.55 |
| Molecular Formula: | C20 H23 N3 O2 S2 |
| Smiles: | CC1CCC(CC1)NC(CCN1C(c2c(c3ccccc3s2)NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.299 |
| logD: | 4.2984 |
| logSw: | -4.1269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.988 |
| InChI Key: | OXXARXWTDUCKKK-UHFFFAOYSA-N |