(4-butylphenyl)[3-(2-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]methanone
Chemical Structure Depiction of
(4-butylphenyl)[3-(2-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]methanone
(4-butylphenyl)[3-(2-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]methanone
Compound characteristics
| Compound ID: | V014-5633 |
| Compound Name: | (4-butylphenyl)[3-(2-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]methanone |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C22 H24 N4 O S |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)C(N1CCSc2nnc(c3ccccc3C)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9678 |
| logD: | 4.9678 |
| logSw: | -4.5711 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.99 |
| InChI Key: | ACFQZKQGHPXXDJ-UHFFFAOYSA-N |