3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl](methyl)carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl](methyl)carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl](methyl)carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6295 |
| Compound Name: | 3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl](methyl)carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 370.2 |
| Molecular Formula: | C13 H16 Br N5 O3 |
| Smiles: | CCn1c(CN(C)C(c2c(cn(C)n2)C(O)=O)=O)c(cn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.3295 |
| logD: | -3.2453 |
| logSw: | -0.8842 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.588 |
| InChI Key: | MIAFUPOJSVLSAI-UHFFFAOYSA-N |