(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)(3-methoxyphenyl)methanone
Chemical Structure Depiction of
(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)(3-methoxyphenyl)methanone
(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)(3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | V017-9037 |
| Compound Name: | (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)(3-methoxyphenyl)methanone |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(N1CCSc2nnc(COc3ccc4CCCc4c3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1736 |
| logD: | 3.1736 |
| logSw: | -3.2972 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.295 |
| InChI Key: | FWFLCQRIELYPBJ-UHFFFAOYSA-N |