5-tert-butyl-N-(3-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-(3-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-tert-butyl-N-(3-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3824 |
| Compound Name: | 5-tert-butyl-N-(3-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 350.82 |
| Molecular Formula: | C18 H20 Cl F N2 O2 |
| Smiles: | CC(C)(C)C1CCc2c(C1)c(C(Nc1ccc(c(c1)[Cl])F)=O)no2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2404 |
| logD: | 5.1348 |
| logSw: | -5.6971 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.729 |
| InChI Key: | INIMCWPGDGPOKV-SNVBAGLBSA-N |