ethyl 1-[3-({[4-(methoxymethyl)-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-({[4-(methoxymethyl)-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
ethyl 1-[3-({[4-(methoxymethyl)-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Compound characteristics
Compound ID: | V017-0402 |
Compound Name: | ethyl 1-[3-({[4-(methoxymethyl)-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate |
Molecular Weight: | 498.64 |
Molecular Formula: | C26 H34 N4 O4 S |
Salt: | not_available |
Smiles: | CCOC(C1CCCN(C1)C(c1cccc(CSc2nc(COC)cc(n2)N2CCCC2)c1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.949 |
logD: | 3.9488 |
logSw: | -3.9183 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 66.797 |
InChI Key: | ALUKIWUSFVEZGO-NRFANRHFSA-N |