{3-[(4-tert-butylphenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetic acid--hydrogen bromide (1/1)
Chemical Structure Depiction of
{3-[(4-tert-butylphenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetic acid--hydrogen bromide (1/1)
{3-[(4-tert-butylphenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetic acid--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 2226-0410 |
| Compound Name: | {3-[(4-tert-butylphenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetic acid--hydrogen bromide (1/1) |
| Molecular Weight: | 418.33 |
| Molecular Formula: | C20 H23 N3 O2 |
| Salt: | HBr |
| Smiles: | CC(C)(C)c1ccc(CN2C(=N)N(CC(O)=O)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4918 |
| logD: | 0.1685 |
| logSw: | -3.3716 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.238 |
| InChI Key: | SXHRTTXAJKTLNQ-UHFFFAOYSA-N |