methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamamido}benzoate
methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | Y205-2497 |
| Compound Name: | methyl 2-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | Cn1cc(CNC(Nc2ccccc2C(=O)OC)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 0.8252 |
| logD: | 0.8246 |
| logSw: | -2.0955 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.149 |
| InChI Key: | PTSADHYXSXGMBK-UHFFFAOYSA-N |