8-butyl-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
8-butyl-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-butyl-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8012-9819 |
| Compound Name: | 8-butyl-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 385.85 |
| Molecular Formula: | C19 H20 Cl N5 O2 |
| Smiles: | CCCCN1C(=Cn2c3C(N(C)C(N(C)c3nc12)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2796 |
| logD: | 4.2796 |
| logSw: | -4.4559 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.204 |
| InChI Key: | HKBUVIUVXOQVIV-UHFFFAOYSA-N |