6-(4-nitrophenyl)-3-(phenoxymethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
6-(4-nitrophenyl)-3-(phenoxymethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
6-(4-nitrophenyl)-3-(phenoxymethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | G786-0573 |
| Compound Name: | 6-(4-nitrophenyl)-3-(phenoxymethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 367.38 |
| Molecular Formula: | C17 H13 N5 O3 S |
| Smiles: | C(c1nnc2n1N=C(CS2)c1ccc(cc1)[N+]([O-])=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.31 |
| logD: | 3.1316 |
| logSw: | -3.634 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.815 |
| InChI Key: | CKNQJDKZVZNADC-UHFFFAOYSA-N |