1-cycloheptyl-4-(2,4-dimethoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Chemical Structure Depiction of
1-cycloheptyl-4-(2,4-dimethoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
1-cycloheptyl-4-(2,4-dimethoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Compound characteristics
Compound ID: | 8020-7066 |
Compound Name: | 1-cycloheptyl-4-(2,4-dimethoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one |
Molecular Weight: | 401.53 |
Molecular Formula: | C21 H27 N3 O3 S |
Smiles: | CC1=NC2=C(C(c3ccc(cc3OC)OC)S1)C(NN2C1CCCCCC1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6368 |
logD: | 4.6364 |
logSw: | -4.432 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.635 |
InChI Key: | WSPHPFFTYDMEGB-LJQANCHMSA-N |