N-cyclohexyl-4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-cyclohexyl-4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
N-cyclohexyl-4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | C200-2029 |
| Compound Name: | N-cyclohexyl-4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide |
| Molecular Weight: | 540.75 |
| Molecular Formula: | C28 H36 N4 O3 S2 |
| Smiles: | C1CCC(CC1)NC(CCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6674 |
| logD: | 4.6674 |
| logSw: | -4.4595 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.638 |
| InChI Key: | VLBXBQXPYFBKND-UHFFFAOYSA-N |