N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | E751-3777 |
| Compound Name: | N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 496.66 |
| Molecular Formula: | C30 H36 N6 O |
| Smiles: | Cc1ccc(cc1)n1c(c(C(NCCN2CCN(CC2)c2cccc(C)c2C)=O)c(C)n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1584 |
| logD: | 5.0454 |
| logSw: | -5.0634 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.645 |
| InChI Key: | KEJGCLARKBQJCB-UHFFFAOYSA-N |