2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-0014 |
| Compound Name: | 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 360.47 |
| Molecular Formula: | C19 H24 N2 O3 S |
| Smiles: | CC1CCN(CC1)C(c1ccccc1NC(C1=C(C)OCCS1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2523 |
| logD: | 1.444 |
| logSw: | -3.0475 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.551 |
| InChI Key: | ODVUDPMGPQYBET-UHFFFAOYSA-N |