5-tert-butyl-3-(3-methylbutanoyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-tert-butyl-3-(3-methylbutanoyl)-1,3-benzoxazol-2(3H)-one
5-tert-butyl-3-(3-methylbutanoyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | G558-0155 |
| Compound Name: | 5-tert-butyl-3-(3-methylbutanoyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 275.35 |
| Molecular Formula: | C16 H21 N O3 |
| Smiles: | CC(C)CC(N1C(=O)Oc2ccc(cc12)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7083 |
| logD: | 3.7083 |
| logSw: | -4.1257 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.396 |
| InChI Key: | JSTKWRSXQUZDKK-UHFFFAOYSA-N |