3-methoxy-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-methoxy-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide
3-methoxy-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | 8003-5341 |
| Compound Name: | 3-methoxy-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 356.36 |
| Molecular Formula: | C16 H12 N4 O4 S |
| Smiles: | COc1cccc(c1)C(Nc1nnc(c2ccc(cc2)[N+]([O-])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8187 |
| logD: | 3.8174 |
| logSw: | -4.126 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.528 |
| InChI Key: | XGUOPWWASPRPKC-UHFFFAOYSA-N |