5-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]-1,3,4-thiadiazol-2-amine
5-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | 8016-3350 |
| Compound Name: | 5-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C8 H4 N6 O3 S2 |
| Smiles: | c1cc(c2c(c1[N+]([O-])=O)non2)Sc1nnc(N)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.0373 |
| logD: | 2.0373 |
| logSw: | -2.4638 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.571 |
| InChI Key: | INJHBVXQDDZNKB-UHFFFAOYSA-N |