2-({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
Chemical Structure Depiction of
2-({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
2-({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | C200-2023 |
| Compound Name: | 2-({3-[4-(cyclohexylamino)-4-oxobutyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide |
| Molecular Weight: | 592.78 |
| Molecular Formula: | C31 H36 N4 O4 S2 |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)SC1=Nc2c3ccccc3sc2C(N1CCCC(NC1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8488 |
| logD: | 5.8488 |
| logSw: | -5.6319 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.348 |
| InChI Key: | OXQMKDXKNXRCFM-DEOSSOPVSA-N |