ethyl {5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}acetate
Chemical Structure Depiction of
ethyl {5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}acetate
ethyl {5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}acetate
Compound characteristics
| Compound ID: | 8016-6790 |
| Compound Name: | ethyl {5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}acetate |
| Molecular Weight: | 331.33 |
| Molecular Formula: | C16 H17 N3 O5 |
| Smiles: | CCOC(Cn1c(cc(C)n1)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7097 |
| logD: | 1.7091 |
| logSw: | -2.4317 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.981 |
| InChI Key: | BCVALXQGRWEXAJ-UHFFFAOYSA-N |