2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-5-methyl-2,3-dihydro-1H-benzimidazole
Chemical Structure Depiction of
2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-5-methyl-2,3-dihydro-1H-benzimidazole
2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-5-methyl-2,3-dihydro-1H-benzimidazole
Compound characteristics
| Compound ID: | 4872-0626 |
| Compound Name: | 2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-5-methyl-2,3-dihydro-1H-benzimidazole |
| Molecular Weight: | 296.67 |
| Molecular Formula: | C11 H9 Cl N4 O4 |
| Smiles: | Cc1ccc2c(c1)NC(=C(/C=C(/[N+]([O-])=O)[Cl])[N+]([O-])=O)\N2 |
| Stereo: | ACHIRAL |
| logP: | 2.6313 |
| logD: | 2.6299 |
| logSw: | -3.4709 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.172 |
| InChI Key: | WWDKFBRZHNTZKR-UHFFFAOYSA-N |