N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-methylbutanamide
Chemical Structure Depiction of
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-methylbutanamide
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | 4402-0108 |
| Compound Name: | N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3-methylbutanamide |
| Molecular Weight: | 322.41 |
| Molecular Formula: | C20 H22 N2 O2 |
| Smiles: | CC(C)CC(Nc1cccc(c1)c1nc2cc(C)cc(C)c2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2851 |
| logD: | 5.2851 |
| logSw: | -5.2128 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.431 |
| InChI Key: | OFFFBYUDPVZYPG-UHFFFAOYSA-N |