4-[(1-cyclopentyl-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile
Chemical Structure Depiction of
4-[(1-cyclopentyl-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile
4-[(1-cyclopentyl-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | V021-5099 |
| Compound Name: | 4-[(1-cyclopentyl-2,6-dioxo-3-phenyl-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C24 H21 N5 O2 |
| Salt: | not_available |
| Smiles: | C1CCC(C1)N1C(c2c(ncn2Cc2ccc(C#N)cc2)N(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9296 |
| logD: | 2.9296 |
| logSw: | -3.166 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.918 |
| InChI Key: | HRGDKZWLYBFSBJ-UHFFFAOYSA-N |