N-cyclohexyl-4-[4-oxo-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-cyclohexyl-4-[4-oxo-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
N-cyclohexyl-4-[4-oxo-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | C200-2176 |
| Compound Name: | N-cyclohexyl-4-[4-oxo-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide |
| Molecular Weight: | 574.76 |
| Molecular Formula: | C31 H34 N4 O3 S2 |
| Smiles: | C=CCN(C(CSC1=Nc2c3ccccc3sc2C(N1CCCC(NC1CCCCC1)=O)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.292 |
| logD: | 5.292 |
| logSw: | -5.6592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.786 |
| InChI Key: | JHCHOZMTYHRZIN-UHFFFAOYSA-N |