1-(prop-2-en-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-benzimidazol-2-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(prop-2-en-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-benzimidazol-2-amine--hydrogen chloride (1/1)
1-(prop-2-en-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-benzimidazol-2-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D010-0166 |
| Compound Name: | 1-(prop-2-en-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1H-benzimidazol-2-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C20 H23 N3 O3 |
| Salt: | HCl |
| Smiles: | COc1cc(CNc2nc3ccccc3n2CC=C)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6673 |
| logD: | 3.6245 |
| logSw: | -3.9151 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.537 |
| InChI Key: | SQDBZHWPQQSBOO-UHFFFAOYSA-N |