N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-chlorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-chlorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-chlorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
Compound characteristics
Compound ID: | E535-1113 |
Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-5-[(3-chlorobenzene-1-sulfinyl)methyl]furan-2-carboxamide |
Molecular Weight: | 499.07 |
Molecular Formula: | C27 H31 Cl N2 O3 S |
Smiles: | C(CNC(c1ccc(CS(c2cccc(c2)[Cl])=O)o1)=O)CN1CCC(CC1)Cc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 5.1484 |
logD: | 3.1138 |
logSw: | -5.5959 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.186 |
InChI Key: | CKCIIEYUHJGHIP-UHFFFAOYSA-N |