2-[(5-{[(dimethylamino)methylidene]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)acetamide
Chemical Structure Depiction of
2-[(5-{[(dimethylamino)methylidene]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)acetamide
2-[(5-{[(dimethylamino)methylidene]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)acetamide
Compound characteristics
| Compound ID: | 8007-7746 |
| Compound Name: | 2-[(5-{[(dimethylamino)methylidene]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-{[(dimethylamino)methylidene]sulfamoyl}phenyl)acetamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C16 H21 N7 O3 S3 |
| Smiles: | CN(C)/C=N/c1nnc(SCC(Nc2ccc(cc2)S(/N=C/N(C)C)(=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 0.5376 |
| logD: | 0.4704 |
| logSw: | -2.4651 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.087 |
| InChI Key: | SOPGYRUGIDYQLU-UHFFFAOYSA-N |