3,5-dichloro-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3,5-dichloro-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
3,5-dichloro-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | 0800-1197 |
| Compound Name: | 3,5-dichloro-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 428.27 |
| Molecular Formula: | C14 H7 Cl2 N5 O3 S2 |
| Smiles: | C(\c1ccc([N+]([O-])=O)s1)=N/c1nnc(NC(c2cc(cc(c2)[Cl])[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.159 |
| logD: | 2.2496 |
| logSw: | -5.7171 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.794 |
| InChI Key: | NPOQKPYCDMYVAW-UHFFFAOYSA-N |