5-{[(2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
5-{[(2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8017-1186 |
| Compound Name: | 5-{[(2-hydroxyphenyl)methyl]amino}-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 214.22 |
| Molecular Formula: | C11 H10 N4 O |
| Smiles: | C(c1ccccc1O)Nc1c(C#N)cn[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.0933 |
| logD: | 1.093 |
| logSw: | -1.6527 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.408 |
| InChI Key: | XYMKCFSFZZRNLU-UHFFFAOYSA-N |