4-({[(1-methyl-1H-pyrazol-4-yl)methyl]amino}methyl)benzoic acid
Chemical Structure Depiction of
4-({[(1-methyl-1H-pyrazol-4-yl)methyl]amino}methyl)benzoic acid
4-({[(1-methyl-1H-pyrazol-4-yl)methyl]amino}methyl)benzoic acid
Compound characteristics
| Compound ID: | Y507-0692 |
| Compound Name: | 4-({[(1-methyl-1H-pyrazol-4-yl)methyl]amino}methyl)benzoic acid |
| Molecular Weight: | 245.28 |
| Molecular Formula: | C13 H15 N3 O2 |
| Smiles: | Cn1cc(CNCc2ccc(cc2)C(O)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 0.9195 |
| logD: | 0.9195 |
| logSw: | -1.5933 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.221 |
| InChI Key: | UJYHYXBJWYORGO-UHFFFAOYSA-N |