3-chloro-N-(5-hexyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide
Chemical Structure Depiction of
3-chloro-N-(5-hexyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide
3-chloro-N-(5-hexyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8004-9817 |
| Compound Name: | 3-chloro-N-(5-hexyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide |
| Molecular Weight: | 368.84 |
| Molecular Formula: | C15 H17 Cl N4 O3 S |
| Smiles: | CCCCCCc1nnc(NC(c2ccc(c(c2)[Cl])[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.1065 |
| logD: | 3.3766 |
| logSw: | -5.6382 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.45 |
| InChI Key: | IOOGAILYDCIEKS-UHFFFAOYSA-N |