N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)[1,1'-biphenyl]-4-carboxamide
Chemical Structure Depiction of
N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)[1,1'-biphenyl]-4-carboxamide
N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)[1,1'-biphenyl]-4-carboxamide
Compound characteristics
| Compound ID: | 0800-1218 |
| Compound Name: | N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)[1,1'-biphenyl]-4-carboxamide |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C20 H13 N5 O3 S2 |
| Smiles: | C(\c1ccc([N+]([O-])=O)s1)=N/c1nnc(NC(c2ccc(cc2)c2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.3938 |
| logD: | 4.3243 |
| logSw: | -5.9794 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.523 |
| InChI Key: | PCFRITRUBLQUIW-UHFFFAOYSA-N |