ethyl 1-{3-[({4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[({4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
ethyl 1-{3-[({4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V001-5696 |
| Compound Name: | ethyl 1-{3-[({4,5-dimethyl-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperidine-3-carboxylate |
| Molecular Weight: | 484.66 |
| Molecular Formula: | C26 H36 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1c(C)c(C)nc(n1)SCc1cccc(c1)C(N1CCCC(C1)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4596 |
| logD: | 4.44 |
| logSw: | -4.3426 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.31 |
| InChI Key: | GCHCDEPDTPPLDF-QFIPXVFZSA-N |