3-(3,3-dimethylbutanamido)benzoic acid
Chemical Structure Depiction of
3-(3,3-dimethylbutanamido)benzoic acid
3-(3,3-dimethylbutanamido)benzoic acid
Compound characteristics
| Compound ID: | Y700-0874 |
| Compound Name: | 3-(3,3-dimethylbutanamido)benzoic acid |
| Molecular Weight: | 235.28 |
| Molecular Formula: | C13 H17 N O3 |
| Smiles: | CC(C)(C)CC(Nc1cccc(c1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3768 |
| logD: | 0.491 |
| logSw: | -3.4056 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.796 |
| InChI Key: | FLPJVCYHCRNXQX-UHFFFAOYSA-N |