5-bromo-2-{[2-methoxy-4-(prop-2-en-1-yl)phenoxy]methyl}-1H-benzimidazole
Chemical Structure Depiction of
5-bromo-2-{[2-methoxy-4-(prop-2-en-1-yl)phenoxy]methyl}-1H-benzimidazole
5-bromo-2-{[2-methoxy-4-(prop-2-en-1-yl)phenoxy]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D670-0129 |
| Compound Name: | 5-bromo-2-{[2-methoxy-4-(prop-2-en-1-yl)phenoxy]methyl}-1H-benzimidazole |
| Molecular Weight: | 373.25 |
| Molecular Formula: | C18 H17 Br N2 O2 |
| Smiles: | COc1cc(CC=C)ccc1OCc1nc2cc(ccc2[nH]1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6105 |
| logD: | 4.6104 |
| logSw: | -4.5158 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.465 |
| InChI Key: | CPDKDUZUCLOVQI-UHFFFAOYSA-N |