1-cycloheptyl-4-(7-methoxy-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-(7-methoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
1-cycloheptyl-4-(7-methoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Compound characteristics
| Compound ID: | 8020-7039 |
| Compound Name: | 1-cycloheptyl-4-(7-methoxy-2H-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C21 H25 N3 O4 S |
| Smiles: | CC1=NC2=C(C(c3cc(c4c(c3)OCO4)OC)S1)C(NN2C1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4292 |
| logD: | 4.4288 |
| logSw: | -4.21 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.891 |
| InChI Key: | IDVRIMZEXLIAIE-LJQANCHMSA-N |