2,2-dimethyl-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}propanamide
Chemical Structure Depiction of
2,2-dimethyl-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}propanamide
2,2-dimethyl-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}propanamide
Compound characteristics
| Compound ID: | 4673-0453 |
| Compound Name: | 2,2-dimethyl-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}propanamide |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C21 H23 N3 O S2 |
| Smiles: | CC(C)(C)C(Nc1ccccc1Sc1c2c3CCCCc3sc2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4059 |
| logD: | 5.4059 |
| logSw: | -5.4874 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.598 |
| InChI Key: | ZTJONEHECVIMIG-UHFFFAOYSA-N |