3-methyl-N-[(2-methylphenyl)methyl]-N-[4-(2-oxo-2-{[2-(piperidin-1-yl)ethyl]amino}ethyl)phenyl]butanamide
Chemical Structure Depiction of
3-methyl-N-[(2-methylphenyl)methyl]-N-[4-(2-oxo-2-{[2-(piperidin-1-yl)ethyl]amino}ethyl)phenyl]butanamide
3-methyl-N-[(2-methylphenyl)methyl]-N-[4-(2-oxo-2-{[2-(piperidin-1-yl)ethyl]amino}ethyl)phenyl]butanamide
Compound characteristics
| Compound ID: | V025-8780 |
| Compound Name: | 3-methyl-N-[(2-methylphenyl)methyl]-N-[4-(2-oxo-2-{[2-(piperidin-1-yl)ethyl]amino}ethyl)phenyl]butanamide |
| Molecular Weight: | 449.64 |
| Molecular Formula: | C28 H39 N3 O2 |
| Smiles: | CC(C)CC(N(Cc1ccccc1C)c1ccc(CC(NCCN2CCCCC2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6334 |
| logD: | 2.8405 |
| logSw: | -4.061 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.358 |
| InChI Key: | XIGAYXGTZRTDQY-UHFFFAOYSA-N |