3-[(3-chlorophenyl)methyl]-1-methyl-8-(3-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
3-[(3-chlorophenyl)methyl]-1-methyl-8-(3-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
3-[(3-chlorophenyl)methyl]-1-methyl-8-(3-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | E461-0528 |
| Compound Name: | 3-[(3-chlorophenyl)methyl]-1-methyl-8-(3-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | Cc1cccc(c1)N1CCn2c3C(N(Cc4cccc(c4)[Cl])C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8928 |
| logD: | 3.8785 |
| logSw: | -4.7781 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.149 |
| InChI Key: | NSVSQUSTAAGUAQ-UHFFFAOYSA-N |