(4-tert-butylphenyl)(3-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl)methanone
Chemical Structure Depiction of
(4-tert-butylphenyl)(3-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl)methanone
(4-tert-butylphenyl)(3-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl)methanone
Compound characteristics
| Compound ID: | V019-0644 |
| Compound Name: | (4-tert-butylphenyl)(3-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl)methanone |
| Molecular Weight: | 448.59 |
| Molecular Formula: | C25 H28 N4 O2 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N1CCSc2nnc(COc3ccc4CCCc4c3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.99 |
| logD: | 4.99 |
| logSw: | -4.7145 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.751 |
| InChI Key: | ALCDRXBNANECLY-UHFFFAOYSA-N |