1-[2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
Chemical Structure Depiction of
1-[2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
1-[2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 3260-0340 |
| Compound Name: | 1-[2-imino-3-(prop-2-en-1-yl)-2,3-dihydro-1H-benzimidazol-1-yl]-3,3-dimethylbutan-2-one--hydrogen bromide (1/1) |
| Molecular Weight: | 352.27 |
| Molecular Formula: | C16 H21 N3 O |
| Salt: | HBr |
| Smiles: | CC(C)(C)C(CN1C(=N)N(CC=C)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0651 |
| logD: | 2.7811 |
| logSw: | -3.3592 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.351 |
| InChI Key: | HMXPFULHRKVCNO-UHFFFAOYSA-N |