5-tert-butyl-N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-tert-butyl-N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3869 |
| Compound Name: | 5-tert-butyl-N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 426.95 |
| Molecular Formula: | C23 H27 Cl N4 O2 |
| Smiles: | Cc1cc(NC(c2c3CC(CCc3on2)C(C)(C)C)=O)nn1Cc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.398 |
| logD: | 5.2941 |
| logSw: | -5.9241 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.226 |
| InChI Key: | WPVLCZMONZCISA-MRXNPFEDSA-N |