5-[4-(ethoxycarbonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-[4-(ethoxycarbonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
5-[4-(ethoxycarbonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8468 |
| Compound Name: | 5-[4-(ethoxycarbonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 310.31 |
| Molecular Formula: | C13 H18 N4 O5 |
| Smiles: | CCOC(N1CCN(CC1)C(c1c(cnn1C)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1851 |
| logD: | -3.3896 |
| logSw: | -0.9116 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.591 |
| InChI Key: | OXOBSMBOOLEPCQ-UHFFFAOYSA-N |