ethyl 1-[3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
ethyl 1-[3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V019-2240 |
| Compound Name: | ethyl 1-[3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 482.64 |
| Molecular Formula: | C26 H34 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1cccc(c1)C(N1CCC(CC1)C(=O)OCC)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7327 |
| logD: | 4.7323 |
| logSw: | -4.471 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.439 |
| InChI Key: | WJIQBWRBADUZRF-UHFFFAOYSA-N |