N-(1H-indole-2-carbonyl)-beta-alanine
Chemical Structure Depiction of
N-(1H-indole-2-carbonyl)-beta-alanine
N-(1H-indole-2-carbonyl)-beta-alanine
Compound characteristics
| Compound ID: | Y040-9186 |
| Compound Name: | N-(1H-indole-2-carbonyl)-beta-alanine |
| Molecular Weight: | 232.24 |
| Molecular Formula: | C12 H12 N2 O3 |
| Smiles: | C(CNC(c1cc2ccccc2[nH]1)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9616 |
| logD: | -1.7341 |
| logSw: | -2.285 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.498 |
| InChI Key: | PTQHKWPEDMLEOW-UHFFFAOYSA-N |