3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8019-0581 |
| Compound Name: | 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 427.26 |
| Molecular Formula: | C17 H12 Cl2 N2 O5 S |
| Smiles: | COc1cc(c(cc1NC(c1c(c2cccc(c2s1)[N+]([O-])=O)[Cl])=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1678 |
| logD: | 4.2877 |
| logSw: | -5.8387 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.72 |
| InChI Key: | HYIGIRQELOPDLQ-UHFFFAOYSA-N |