1-cycloheptyl-4-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Chemical Structure Depiction of
1-cycloheptyl-4-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
1-cycloheptyl-4-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Compound characteristics
| Compound ID: | 8020-6986 |
| Compound Name: | 1-cycloheptyl-4-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | CC1=NC2=C(C(c3cc4c(c(c3OC)OC)OCO4)S1)C(NN2C1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3196 |
| logD: | 4.3192 |
| logSw: | -4.1899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.695 |
| InChI Key: | UORPMEJPVYECHZ-HXUWFJFHSA-N |