N-(3-methylbenzoyl)-beta-alanine
Chemical Structure Depiction of
N-(3-methylbenzoyl)-beta-alanine
N-(3-methylbenzoyl)-beta-alanine
Compound characteristics
| Compound ID: | Y031-6650 |
| Compound Name: | N-(3-methylbenzoyl)-beta-alanine |
| Molecular Weight: | 207.23 |
| Molecular Formula: | C11 H13 N O3 |
| Smiles: | Cc1cccc(c1)C(NCCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5188 |
| logD: | -2.1769 |
| logSw: | -1.7492 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.149 |
| InChI Key: | NBRIQMGRSUGDRU-UHFFFAOYSA-N |