N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | L895-0305 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | C1CC(CN(C1)c1c(nccn1)Sc1ccccc1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0074 |
| logD: | 3.0071 |
| logSw: | -3.3968 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.427 |
| InChI Key: | MLCYICAALVSIAL-KRWDZBQOSA-N |