8-(2H-1,3-benzodioxol-5-yl)-6-ethyl-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
8-(2H-1,3-benzodioxol-5-yl)-6-ethyl-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-(2H-1,3-benzodioxol-5-yl)-6-ethyl-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8014-9028 |
| Compound Name: | 8-(2H-1,3-benzodioxol-5-yl)-6-ethyl-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C24 H21 N5 O4 |
| Smiles: | CCC1=C(c2ccccc2)N(c2ccc3c(c2)OCO3)c2nc3c(C(N(C)C(N3C)=O)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.3418 |
| logD: | 4.3418 |
| logSw: | -4.3599 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.09 |
| InChI Key: | LZLJZFCNLCMMGP-UHFFFAOYSA-N |