1-[2-tert-butyl-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
Chemical Structure Depiction of
1-[2-tert-butyl-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
1-[2-tert-butyl-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane
Compound characteristics
| Compound ID: | 7294-0859 |
| Compound Name: | 1-[2-tert-butyl-4-(4-methylbenzene-1-sulfonyl)-1,3-oxazol-5-yl]azepane |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C20 H28 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(c1c(N2CCCCCC2)oc(C(C)(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3233 |
| logD: | 5.3233 |
| logSw: | -5.1643 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.081 |
| InChI Key: | DXIMQAUTURUDHH-UHFFFAOYSA-N |