N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-0523 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 478.65 |
| Molecular Formula: | C28 H34 N2 O3 S |
| Smiles: | Cc1cccc(c1)S(Cc1ccc(C(NCCCN2CCC(CC2)Cc2ccccc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9787 |
| logD: | 2.9442 |
| logSw: | -4.6519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.186 |
| InChI Key: | CHGCIKGNYXILLY-UHFFFAOYSA-N |