2-[(5-bromo-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Chemical Structure Depiction of
2-[(5-bromo-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
2-[(5-bromo-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Compound characteristics
| Compound ID: | D058-0128 |
| Compound Name: | 2-[(5-bromo-1H-benzimidazol-2-yl)sulfanyl]propanoic acid |
| Molecular Weight: | 301.16 |
| Molecular Formula: | C10 H9 Br N2 O2 S |
| Smiles: | CC(C(O)=O)Sc1nc2cc(ccc2[nH]1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2721 |
| logD: | -0.9343 |
| logSw: | -2.6905 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.66 |
| InChI Key: | QQRYPZOCADTCGF-YFKPBYRVSA-N |