4-{[(2-chlorophenyl)methyl]amino}-1-ethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-{[(2-chlorophenyl)methyl]amino}-1-ethyl-1H-pyrazole-3-carboxylic acid
4-{[(2-chlorophenyl)methyl]amino}-1-ethyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8773 |
| Compound Name: | 4-{[(2-chlorophenyl)methyl]amino}-1-ethyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 279.72 |
| Molecular Formula: | C13 H14 Cl N3 O2 |
| Smiles: | CCn1cc(c(C(O)=O)n1)NCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.7859 |
| logD: | -0.9754 |
| logSw: | -2.4292 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.232 |
| InChI Key: | FUSIGCWCTLYXAM-UHFFFAOYSA-N |