ethyl {[1-(2-nitrobenzoyl)-1H-benzimidazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[1-(2-nitrobenzoyl)-1H-benzimidazol-2-yl]sulfanyl}acetate
ethyl {[1-(2-nitrobenzoyl)-1H-benzimidazol-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 4769-0603 |
| Compound Name: | ethyl {[1-(2-nitrobenzoyl)-1H-benzimidazol-2-yl]sulfanyl}acetate |
| Molecular Weight: | 385.4 |
| Molecular Formula: | C18 H15 N3 O5 S |
| Smiles: | CCOC(CSc1nc2ccccc2n1C(c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9707 |
| logD: | 2.9707 |
| logSw: | -3.6534 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.927 |
| InChI Key: | JWHXLOCQZVHRBB-UHFFFAOYSA-N |