(azepan-1-yl)[6-(4-chlorophenyl)-3-methyl-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-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
(azepan-1-yl)[6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
Compound characteristics
| Compound ID: | 7238-1038 |
| Compound Name: | (azepan-1-yl)[6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C18 H22 Cl N5 O S |
| Smiles: | Cc1nnc2n1NC(C(C(N1CCCCCC1)=O)S2)c1ccc(cc1)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0389 |
| logD: | 3.0389 |
| logSw: | -3.8237 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.72 |
| InChI Key: | HULVCQBMBCYTOK-UHFFFAOYSA-N |