methyl 4-(1-cycloheptyl-6-methyl-3-oxo-1,2,3,4-tetrahydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(1-cycloheptyl-6-methyl-3-oxo-1,2,3,4-tetrahydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoate
methyl 4-(1-cycloheptyl-6-methyl-3-oxo-1,2,3,4-tetrahydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoate
Compound characteristics
| Compound ID: | 8020-7060 |
| Compound Name: | methyl 4-(1-cycloheptyl-6-methyl-3-oxo-1,2,3,4-tetrahydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoate |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C21 H25 N3 O3 S |
| Smiles: | CC1=NC2=C(C(c3ccc(cc3)C(=O)OC)S1)C(NN2C1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6964 |
| logD: | 4.696 |
| logSw: | -4.3319 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.635 |
| InChI Key: | GSNTXWRFGBKUIG-GOSISDBHSA-N |