(azepan-1-yl)[6-(4-methylphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[6-(4-methylphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
(azepan-1-yl)[6-(4-methylphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
Compound characteristics
| Compound ID: | 7238-2062 |
| Compound Name: | (azepan-1-yl)[6-(4-methylphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C24 H27 N5 O S |
| Smiles: | Cc1ccc(cc1)C1C(C(N2CCCCCC2)=O)Sc2nnc(c3ccccc3)n2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7989 |
| logD: | 4.7988 |
| logSw: | -4.4567 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.671 |
| InChI Key: | YAFHLFGTVQUECD-UHFFFAOYSA-N |