methyl 2-[(4-bromo-1-ethyl-1H-pyrazole-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-bromo-1-ethyl-1H-pyrazole-3-carbonyl)amino]benzoate
methyl 2-[(4-bromo-1-ethyl-1H-pyrazole-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y207-5397 |
| Compound Name: | methyl 2-[(4-bromo-1-ethyl-1H-pyrazole-3-carbonyl)amino]benzoate |
| Molecular Weight: | 352.18 |
| Molecular Formula: | C14 H14 Br N3 O3 |
| Smiles: | CCn1cc(c(C(Nc2ccccc2C(=O)OC)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.4504 |
| logD: | 2.0221 |
| logSw: | -2.8474 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.854 |
| InChI Key: | KLDTVFPVUSOHRN-UHFFFAOYSA-N |