5-tert-butyl-N-(2-chloropyridin-3-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-(2-chloropyridin-3-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
5-tert-butyl-N-(2-chloropyridin-3-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3830 |
| Compound Name: | 5-tert-butyl-N-(2-chloropyridin-3-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 333.82 |
| Molecular Formula: | C17 H20 Cl N3 O2 |
| Smiles: | CC(C)(C)C1CCc2c(C1)c(C(Nc1cccnc1[Cl])=O)no2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9463 |
| logD: | 3.9413 |
| logSw: | -4.253 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.717 |
| InChI Key: | GVTWEMHABDZZQX-SNVBAGLBSA-N |