3-methoxy-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3-methoxy-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
3-methoxy-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | 0800-1189 |
| Compound Name: | 3-methoxy-N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 389.41 |
| Molecular Formula: | C15 H11 N5 O4 S2 |
| Smiles: | COc1cccc(c1)C(Nc1nnc(/N=C/c2ccc([N+]([O-])=O)s2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7372 |
| logD: | 3.1148 |
| logSw: | -4.1392 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.338 |
| InChI Key: | XGRNHTOHEUIQAV-LZYBPNLTSA-N |