methyl {3-[(2-chlorophenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
Chemical Structure Depiction of
methyl {3-[(2-chlorophenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
methyl {3-[(2-chlorophenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1)
Compound characteristics
Compound ID: | 2226-0415 |
Compound Name: | methyl {3-[(2-chlorophenyl)methyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}acetate--hydrogen bromide (1/1) |
Molecular Weight: | 410.7 |
Molecular Formula: | C17 H16 Cl N3 O2 |
Salt: | HBr |
Smiles: | COC(CN1C(=N)N(Cc2ccccc2[Cl])c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 3.2412 |
logD: | 2.8113 |
logSw: | -3.437 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.433 |
InChI Key: | UBEPHULSBBHQPD-UHFFFAOYSA-N |