3-chloro-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
Chemical Structure Depiction of
3-chloro-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
3-chloro-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1067-0275 |
| Compound Name: | 3-chloro-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide |
| Molecular Weight: | 374.8 |
| Molecular Formula: | C16 H11 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1)c1nnc(NC(c2ccc(c(c2)[Cl])[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.6191 |
| logD: | 4.5606 |
| logSw: | -4.8575 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.684 |
| InChI Key: | QQGYKIGYLWGMGX-UHFFFAOYSA-N |