3-[(2-chloro-6-fluorophenyl)methyl]-8-(3,5-dimethylphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
3-[(2-chloro-6-fluorophenyl)methyl]-8-(3,5-dimethylphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
3-[(2-chloro-6-fluorophenyl)methyl]-8-(3,5-dimethylphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | E461-0686 |
| Compound Name: | 3-[(2-chloro-6-fluorophenyl)methyl]-8-(3,5-dimethylphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 453.9 |
| Molecular Formula: | C23 H21 Cl F N5 O2 |
| Smiles: | Cc1cc(C)cc(c1)N1CCn2c3C(N(Cc4c(cccc4[Cl])F)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2253 |
| logD: | 3.4977 |
| logSw: | -5.7075 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.149 |
| InChI Key: | VBJUIJLMFGITGE-UHFFFAOYSA-N |