N-(5-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(5-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(5-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1599 |
| Compound Name: | N-(5-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C28 H35 N3 O3 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NCCCN1CCC(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9784 |
| logD: | 1.9438 |
| logSw: | -4.0811 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.226 |
| InChI Key: | USEODKMLPVHDGJ-UHFFFAOYSA-N |