N-(3,4-dimethylphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide
N-(3,4-dimethylphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S451-0301 |
| Compound Name: | N-(3,4-dimethylphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 280.33 |
| Molecular Formula: | C16 H16 N4 O |
| Smiles: | Cc1ccc(cc1C)NC(c1cc(c2ccc[nH]2)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8372 |
| logD: | 3.8372 |
| logSw: | -3.8941 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 55.886 |
| InChI Key: | MSPJYQDFEIIGGV-UHFFFAOYSA-N |