3-({1-[(furan-2-yl)methyl]-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)benzonitrile
Chemical Structure Depiction of
3-({1-[(furan-2-yl)methyl]-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)benzonitrile
3-({1-[(furan-2-yl)methyl]-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V019-9630 |
| Compound Name: | 3-({1-[(furan-2-yl)methyl]-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)benzonitrile |
| Molecular Weight: | 423.43 |
| Molecular Formula: | C24 H17 N5 O3 |
| Salt: | not_available |
| Smiles: | C(c1ccco1)N1C(c2c(ncn2Cc2cccc(C#N)c2)N(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6592 |
| logD: | 2.6592 |
| logSw: | -2.9686 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.079 |
| InChI Key: | QWXXRADPSHURMM-UHFFFAOYSA-N |