N-(4-chloro-2,5-dimethoxyphenyl)-3,5-dinitro-2-(4-phenoxyanilino)benzamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-3,5-dinitro-2-(4-phenoxyanilino)benzamide
N-(4-chloro-2,5-dimethoxyphenyl)-3,5-dinitro-2-(4-phenoxyanilino)benzamide
Compound characteristics
| Compound ID: | 8008-4568 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-3,5-dinitro-2-(4-phenoxyanilino)benzamide |
| Molecular Weight: | 564.94 |
| Molecular Formula: | C27 H21 Cl N4 O8 |
| Smiles: | COc1cc(c(cc1NC(c1cc(cc(c1Nc1ccc(cc1)Oc1ccccc1)[N+]([O-])=O)[N+]([O-])=O)=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2193 |
| logD: | 4.7969 |
| logSw: | -6.0993 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.619 |
| InChI Key: | PKRUWWOHEBQXOE-UHFFFAOYSA-N |