N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(2,3-dichlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(2,3-dichlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(2,3-dichlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K292-0865 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(2,3-dichlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 494.46 |
| Molecular Formula: | C22 H21 Cl2 N3 O2 S2 |
| Smiles: | C1CCC(CCNC(CSC2=Nc3ccsc3C(N2c2cccc(c2[Cl])[Cl])=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.0331 |
| logD: | 5.0331 |
| logSw: | -5.1268 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.382 |
| InChI Key: | BRIHSXVRUYNHSC-UHFFFAOYSA-N |