(4-{2-(2,4-dimethylphenyl)-5-[3-oxo-3-(piperidin-1-yl)propyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Chemical Structure Depiction of
(4-{2-(2,4-dimethylphenyl)-5-[3-oxo-3-(piperidin-1-yl)propyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
(4-{2-(2,4-dimethylphenyl)-5-[3-oxo-3-(piperidin-1-yl)propyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Compound characteristics
| Compound ID: | V010-7390 |
| Compound Name: | (4-{2-(2,4-dimethylphenyl)-5-[3-oxo-3-(piperidin-1-yl)propyl]-1H-pyrrol-1-yl}phenyl)acetonitrile |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C28 H31 N3 O |
| Smiles: | Cc1ccc(c(C)c1)c1ccc(CCC(N2CCCCC2)=O)n1c1ccc(CC#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.214 |
| logD: | 5.214 |
| logSw: | -4.9275 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.008 |
| InChI Key: | VDUGMNCAWVONCR-UHFFFAOYSA-N |