4-methoxy-3-nitro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
4-methoxy-3-nitro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
4-methoxy-3-nitro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | Y032-2458 |
| Compound Name: | 4-methoxy-3-nitro-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 348.26 |
| Molecular Formula: | C11 H7 F3 N4 O4 S |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(Nc1nnc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5348 |
| logD: | -1.5589 |
| logSw: | -3.115 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.586 |
| InChI Key: | JKCDGDLTCBHBDD-UHFFFAOYSA-N |