methyl [2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]acetate--hydrogen bromide (1/1)
Chemical Structure Depiction of
methyl [2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]acetate--hydrogen bromide (1/1)
methyl [2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]acetate--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 3260-0142 |
| Compound Name: | methyl [2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]acetate--hydrogen bromide (1/1) |
| Molecular Weight: | 326.19 |
| Molecular Formula: | C13 H15 N3 O2 |
| Salt: | HBr |
| Smiles: | COC(CN1C(=N)N(CC=C)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6412 |
| logD: | 1.3559 |
| logSw: | -2.056 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.683 |
| InChI Key: | FGSYDLODIWBCNZ-UHFFFAOYSA-N |