5-tert-butyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-tert-butyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-6600 |
| Compound Name: | 5-tert-butyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C19 H28 N4 O2 |
| Smiles: | Cc1c(CNC(c2c3CC(CCc3on2)C(C)(C)C)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.848 |
| logD: | 2.848 |
| logSw: | -2.9128 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.891 |
| InChI Key: | BQZXCRXQKJWLEX-CYBMUJFWSA-N |