N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-3-methylbutanamide
N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V005-9238 |
| Compound Name: | N-[3-(2H-1,3-benzodioxol-5-yl)-5-(2-methylpropyl)-1H-pyrazol-4-yl]-3-methylbutanamide |
| Molecular Weight: | 343.42 |
| Molecular Formula: | C19 H25 N3 O3 |
| Smiles: | CC(C)CC(Nc1c(c2ccc3c(c2)OCO3)n[nH]c1CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8653 |
| logD: | 3.8653 |
| logSw: | -4.0987 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.633 |
| InChI Key: | MQBLHHAQTIEBST-UHFFFAOYSA-N |