2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)acetamide
Compound characteristics
| Compound ID: | Y032-3712 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)acetamide |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C20 H24 N6 O6 S |
| Smiles: | CN1C(c2c(ncn2CC(Nc2ccc(cc2)S(NCC2CCCO2)(=O)=O)=O)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3356 |
| logD: | 0.3348 |
| logSw: | -2.4907 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.522 |
| InChI Key: | VOCAZDOFZOLXSF-CQSZACIVSA-N |