ethyl 3-(2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 3-(2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamido)benzoate
ethyl 3-(2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
Compound ID: | L981-0892 |
Compound Name: | ethyl 3-(2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamido)benzoate |
Molecular Weight: | 490.62 |
Molecular Formula: | C27 H30 N4 O3 S |
Smiles: | CCOC(c1cccc(c1)NC(CSc1c(nccn1)N1CCC(CC1)Cc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 6.0946 |
logD: | 6.0946 |
logSw: | -5.5455 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.211 |
InChI Key: | ONPCUPKNUZMXAY-UHFFFAOYSA-N |