ethyl 1-[3-({[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-({[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
ethyl 1-[3-({[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V003-5781 |
| Compound Name: | ethyl 1-[3-({[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C26 H36 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1cc(COC)nc(n1)SCc1cccc(c1)C(N1CCCC(C1)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1122 |
| logD: | 4.112 |
| logSw: | -4.2476 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.714 |
| InChI Key: | MRQWOPDAVPOBFN-NRFANRHFSA-N |