[3-(furan-2-yl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl](4-methyl-3-nitrophenyl)methanone
Chemical Structure Depiction of
[3-(furan-2-yl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl](4-methyl-3-nitrophenyl)methanone
[3-(furan-2-yl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl](4-methyl-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V029-1109 |
| Compound Name: | [3-(furan-2-yl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl](4-methyl-3-nitrophenyl)methanone |
| Molecular Weight: | 371.37 |
| Molecular Formula: | C16 H13 N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(N1CCSc2nnc(c3ccco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1287 |
| logD: | 2.1287 |
| logSw: | -2.5131 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.649 |
| InChI Key: | NQKYJXSXWJRLST-UHFFFAOYSA-N |