4-[2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclohexylbutanamide
Chemical Structure Depiction of
4-[2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclohexylbutanamide
4-[2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclohexylbutanamide
Compound characteristics
| Compound ID: | C200-2024 |
| Compound Name: | 4-[2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclohexylbutanamide |
| Molecular Weight: | 526.12 |
| Molecular Formula: | C27 H28 Cl N3 O2 S2 |
| Smiles: | C1CCC(CC1)NC(CCCN1C(=Nc2c3ccccc3sc2C1=O)SCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.029 |
| logD: | 6.029 |
| logSw: | -6.2048 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.441 |
| InChI Key: | KMENQRQBBORYCN-UHFFFAOYSA-N |