6-butyl-8-(3,4-dimethylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
6-butyl-8-(3,4-dimethylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
6-butyl-8-(3,4-dimethylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
Compound ID: | 8019-4411 |
Compound Name: | 6-butyl-8-(3,4-dimethylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
Molecular Weight: | 455.56 |
Molecular Formula: | C27 H29 N5 O2 |
Smiles: | CCCCC1=C(c2ccccc2)N(c2ccc(C)c(C)c2)c2nc3c(C(N(C)C(N3C)=O)=O)n12 |
Stereo: | ACHIRAL |
logP: | 6.5088 |
logD: | 6.5088 |
logSw: | -5.5389 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 44.975 |
InChI Key: | NJSDIHSCFKFDJQ-UHFFFAOYSA-N |