N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L894-0098 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(4-methylphenyl)sulfanyl]pyrazin-2-yl}piperidine-4-carboxamide |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1)Sc1c(nccn1)N1CCC(CC1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7707 |
| logD: | 3.7705 |
| logSw: | -3.7623 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.494 |
| InChI Key: | HDRSNUAPXLPUQS-UHFFFAOYSA-N |