methyl 3-[(4-bromo-1-ethyl-1H-pyrazole-5-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 3-[(4-bromo-1-ethyl-1H-pyrazole-5-carbonyl)amino]benzoate
methyl 3-[(4-bromo-1-ethyl-1H-pyrazole-5-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y500-7774 |
| Compound Name: | methyl 3-[(4-bromo-1-ethyl-1H-pyrazole-5-carbonyl)amino]benzoate |
| Molecular Weight: | 352.18 |
| Molecular Formula: | C14 H14 Br N3 O3 |
| Smiles: | CCn1c(C(Nc2cccc(c2)C(=O)OC)=O)c(cn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9202 |
| logD: | 2.9177 |
| logSw: | -3.2678 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.458 |
| InChI Key: | HCZMTJURKSAZOP-UHFFFAOYSA-N |