N-butyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-butyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-butyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | E751-3230 |
| Compound Name: | N-butyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 322.41 |
| Molecular Formula: | C19 H22 N4 O |
| Smiles: | CCCCNC(c1cnn(c2ccc(C)cc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8098 |
| logD: | 4.8098 |
| logSw: | -4.4289 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.621 |
| InChI Key: | ITNPCEZIXVZEKJ-UHFFFAOYSA-N |