N-{3,5-dimethyl-1-[(naphthalen-1-yl)methyl]-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(naphthalen-1-yl)methyl]-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{3,5-dimethyl-1-[(naphthalen-1-yl)methyl]-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y200-4210 |
| Compound Name: | N-{3,5-dimethyl-1-[(naphthalen-1-yl)methyl]-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C24 H21 N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2cccc3ccccc23)n1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6877 |
| logD: | 3.6874 |
| logSw: | -4.0835 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.06 |
| InChI Key: | JMVRMNROGBVBFQ-UHFFFAOYSA-N |