(4-{2-(2,4-dimethylphenyl)-5-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Chemical Structure Depiction of
(4-{2-(2,4-dimethylphenyl)-5-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
(4-{2-(2,4-dimethylphenyl)-5-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile
Compound characteristics
| Compound ID: | V007-6983 |
| Compound Name: | (4-{2-(2,4-dimethylphenyl)-5-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-1H-pyrrol-1-yl}phenyl)acetonitrile |
| Molecular Weight: | 454.62 |
| Molecular Formula: | C29 H34 N4 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(CCc1ccc(c2ccc(C)cc2C)n1c1ccc(CC#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3768 |
| logD: | 4.0563 |
| logSw: | -4.1713 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.545 |
| InChI Key: | INPTXAZYQMTOOK-UHFFFAOYSA-N |