N-(4-bromophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
N-(4-bromophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G754-0525 |
| Compound Name: | N-(4-bromophenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide |
| Molecular Weight: | 464.34 |
| Molecular Formula: | C18 H18 Br N5 O3 S |
| Smiles: | C1CC(Cn2c3c(C(NC=N3)=O)nc2SCC(Nc2ccc(cc2)[Br])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1463 |
| logD: | 2.1457 |
| logSw: | -2.7061 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.234 |
| InChI Key: | AUTTUIGNXVCYFI-CYBMUJFWSA-N |