(4-{2-(2,4-dimethylphenyl)-5-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Chemical Structure Depiction of
(4-{2-(2,4-dimethylphenyl)-5-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
(4-{2-(2,4-dimethylphenyl)-5-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Compound characteristics
| Compound ID: | V009-6763 |
| Compound Name: | (4-{2-(2,4-dimethylphenyl)-5-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C28 H32 N4 O |
| Smiles: | Cc1ccc(c(C)c1)c1ccc(CCC(N2CCN(C)CC2)=O)n1c1ccc(CC#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.032 |
| logD: | 3.7851 |
| logSw: | -4.1024 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.485 |
| InChI Key: | SURZHUPNIPDWCZ-UHFFFAOYSA-N |