5-tert-butyl-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-tert-butyl-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
Compound ID: | C226-3876 |
Compound Name: | 5-tert-butyl-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
Molecular Weight: | 420.55 |
Molecular Formula: | C25 H32 N4 O2 |
Smiles: | Cc1ccccc1Cn1c(C)c(c(C)n1)NC(c1c2CC(CCc2on1)C(C)(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7909 |
logD: | 4.79 |
logSw: | -4.438 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.616 |
InChI Key: | GORNLTHDLLQRCG-LJQANCHMSA-N |