4-[(1,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-[(1,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobut-2-enoic acid
4-[(1,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | Y504-9259 |
| Compound Name: | 4-[(1,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobut-2-enoic acid |
| Molecular Weight: | 209.2 |
| Molecular Formula: | C9 H11 N3 O3 |
| Smiles: | Cc1c(cnn1C)NC(\C=C/C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0651 |
| logD: | -4.5234 |
| logSw: | -1.4061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.56 |
| InChI Key: | YFDZPMIJWRDVQN-UHFFFAOYSA-N |