N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3409 |
| Compound Name: | N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | Cc1ccc(Cn2ccc(NC(c3c4CCCCc4on3)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.294 |
| logD: | 3.2843 |
| logSw: | -3.3939 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.685 |
| InChI Key: | YUGLJXVSUFGPLN-UHFFFAOYSA-N |