2-{3-[1-(methanesulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}-N-[(3-methylthiophen-2-yl)methyl]ethan-1-amine
Chemical Structure Depiction of
2-{3-[1-(methanesulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}-N-[(3-methylthiophen-2-yl)methyl]ethan-1-amine
2-{3-[1-(methanesulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}-N-[(3-methylthiophen-2-yl)methyl]ethan-1-amine
Compound characteristics
| Compound ID: | SC17-0021 |
| Compound Name: | 2-{3-[1-(methanesulfonyl)piperidin-4-yl]-1,2,4-oxadiazol-5-yl}-N-[(3-methylthiophen-2-yl)methyl]ethan-1-amine |
| Molecular Weight: | 384.52 |
| Molecular Formula: | C16 H24 N4 O3 S2 |
| Smiles: | Cc1ccsc1CNCCc1nc(C2CCN(CC2)S(C)(=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 1.7171 |
| logD: | -0.0475 |
| logSw: | -2.2564 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.682 |
| InChI Key: | CRKBCESYBZQRPH-UHFFFAOYSA-N |