N-cyclohexyl-4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-cyclohexyl-4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
N-cyclohexyl-4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | C200-2016 |
| Compound Name: | N-cyclohexyl-4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]butanamide |
| Molecular Weight: | 530.71 |
| Molecular Formula: | C26 H34 N4 O4 S2 |
| Smiles: | COCCCNC(CSC1=Nc2c3ccccc3sc2C(N1CCCC(NC1CCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9863 |
| logD: | 2.9863 |
| logSw: | -3.2559 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.368 |
| InChI Key: | JUFOXVLFQCVRFI-UHFFFAOYSA-N |