N-(2,5-difluorophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
N-(2,5-difluorophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | G754-0554 |
Compound Name: | N-(2,5-difluorophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide |
Molecular Weight: | 421.42 |
Molecular Formula: | C18 H17 F2 N5 O3 S |
Smiles: | C1CC(Cn2c3c(C(NC=N3)=O)nc2SCC(Nc2cc(ccc2F)F)=O)OC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.4797 |
logD: | 1.4703 |
logSw: | -2.3991 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.536 |
InChI Key: | RXTPHUKVYZHOPP-LLVKDONJSA-N |