N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzene-1-sulfonamide
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y032-1835 |
| Compound Name: | N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C12 H14 N4 O4 S2 |
| Smiles: | CC(C)(C)c1nnc(NS(c2ccc(cc2)[N+]([O-])=O)(=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.1094 |
| logD: | -1.0154 |
| logSw: | -3.5456 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.814 |
| InChI Key: | WIWRVTXHWSPXQY-UHFFFAOYSA-N |