3-[(4-amino-1H-pyrazol-1-yl)methyl]-4-methoxybenzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[(4-amino-1H-pyrazol-1-yl)methyl]-4-methoxybenzoic acid--hydrogen chloride (1/1)
3-[(4-amino-1H-pyrazol-1-yl)methyl]-4-methoxybenzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y507-2279 |
| Compound Name: | 3-[(4-amino-1H-pyrazol-1-yl)methyl]-4-methoxybenzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 283.71 |
| Molecular Formula: | C12 H13 N3 O3 |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1Cn1cc(cn1)N)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.121 |
| logD: | -1.3678 |
| logSw: | -1.9197 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.589 |
| InChI Key: | DNGGVCSCZOUOMK-UHFFFAOYSA-N |