(5-amino-3-methyl-4-phenyl-1H-pyrazol-1-yl)(2H-1,3-benzodioxol-5-yl)methanone
Chemical Structure Depiction of
(5-amino-3-methyl-4-phenyl-1H-pyrazol-1-yl)(2H-1,3-benzodioxol-5-yl)methanone
(5-amino-3-methyl-4-phenyl-1H-pyrazol-1-yl)(2H-1,3-benzodioxol-5-yl)methanone
Compound characteristics
| Compound ID: | 8014-2328 |
| Compound Name: | (5-amino-3-methyl-4-phenyl-1H-pyrazol-1-yl)(2H-1,3-benzodioxol-5-yl)methanone |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C18 H15 N3 O3 |
| Smiles: | Cc1c(c2ccccc2)c(N)n(C(c2ccc3c(c2)OCO3)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3728 |
| logD: | 2.3728 |
| logSw: | -2.7983 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.947 |
| InChI Key: | GQPVTWCMBUBMTE-UHFFFAOYSA-N |