4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclopentylbutanamide
Chemical Structure Depiction of
4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclopentylbutanamide
4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclopentylbutanamide
Compound characteristics
| Compound ID: | C604-0058 |
| Compound Name: | 4-[2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-cyclopentylbutanamide |
| Molecular Weight: | 526.72 |
| Molecular Formula: | C27 H34 N4 O3 S2 |
| Smiles: | C1CCC(CC1)NC(CSC1=Nc2c3ccccc3sc2C(N1CCCC(NC1CCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2121 |
| logD: | 4.2121 |
| logSw: | -4.1526 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.004 |
| InChI Key: | MFWMRCXGDOPAQK-UHFFFAOYSA-N |