methyl {2-imino-3-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
Chemical Structure Depiction of
methyl {2-imino-3-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
methyl {2-imino-3-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 2226-0419 |
| Compound Name: | methyl {2-imino-3-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1) |
| Molecular Weight: | 399.29 |
| Molecular Formula: | C16 H22 N4 O3 |
| Salt: | HBr |
| Smiles: | COC(CN1C(=N)N(CCN2CCOCC2)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.727 |
| logD: | 0.3681 |
| logSw: | -1.7866 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.302 |
| InChI Key: | SQMXFODMVWYJRA-UHFFFAOYSA-N |