N-{1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl}-N-(oxan-4-yl)-N'-(2-phenylethyl)urea
Chemical Structure Depiction of
N-{1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl}-N-(oxan-4-yl)-N'-(2-phenylethyl)urea
N-{1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl}-N-(oxan-4-yl)-N'-(2-phenylethyl)urea
Compound characteristics
| Compound ID: | S329-4153 |
| Compound Name: | N-{1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl}-N-(oxan-4-yl)-N'-(2-phenylethyl)urea |
| Molecular Weight: | 449.64 |
| Molecular Formula: | C28 H39 N3 O2 |
| Smiles: | Cc1ccc(CN2CCC(CC2)N(C2CCOCC2)C(NCCc2ccccc2)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 5.0612 |
| logD: | 3.2806 |
| logSw: | -4.533 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.209 |
| InChI Key: | KMDYCACASRXDGQ-UHFFFAOYSA-N |