ethyl ({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
ethyl ({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | C200-2015 |
| Compound Name: | ethyl ({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C24 H29 N3 O4 S2 |
| Smiles: | CCOC(CSC1=Nc2c3ccccc3sc2C(N1CCCC(NC1CCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9827 |
| logD: | 3.9827 |
| logSw: | -3.8647 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.871 |
| InChI Key: | NJTHOIPMEHXUHB-UHFFFAOYSA-N |