1-cycloheptyl-4-(3,4-dihydroxy-5-methoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Chemical Structure Depiction of
1-cycloheptyl-4-(3,4-dihydroxy-5-methoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
1-cycloheptyl-4-(3,4-dihydroxy-5-methoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Compound characteristics
| Compound ID: | 8020-7074 |
| Compound Name: | 1-cycloheptyl-4-(3,4-dihydroxy-5-methoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | CC1=NC2=C(C(c3cc(c(c(c3)OC)O)O)S1)C(NN2C1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3461 |
| logD: | 3.3312 |
| logSw: | -3.1194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.119 |
| InChI Key: | BWYKPAMSINVECL-GOSISDBHSA-N |