ethyl 1-(4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
ethyl 1-(4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V026-8298 |
| Compound Name: | ethyl 1-(4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}benzoyl)piperidine-3-carboxylate |
| Molecular Weight: | 606.79 |
| Molecular Formula: | C33 H42 N4 O5 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(N1CCCC(C1)C(=O)OCC)=O)N(C)CCc1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0327 |
| logD: | 5.0282 |
| logSw: | -4.6926 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.748 |
| InChI Key: | HYRPEVIDFORKSJ-SANMLTNESA-N |