2-{[(dimethylamino)methylidene]amino}-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)-4-(4-nitrophenyl)-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-{[(dimethylamino)methylidene]amino}-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)-4-(4-nitrophenyl)-1,3-thiazole-5-carboxamide
2-{[(dimethylamino)methylidene]amino}-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)-4-(4-nitrophenyl)-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | 2650-9165 |
| Compound Name: | 2-{[(dimethylamino)methylidene]amino}-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)-4-(4-nitrophenyl)-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 529.6 |
| Molecular Formula: | C22 H23 N7 O5 S2 |
| Smiles: | CN(C)/C=N/c1nc(c2ccc(cc2)[N+]([O-])=O)c(C(Nc2ccc(cc2)S(/N=C/N(C)C)(=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.1992 |
| logD: | 2.1905 |
| logSw: | -2.971 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.322 |
| InChI Key: | USMJGJVBWXYJPJ-UHFFFAOYSA-N |