7-(4-bromophenyl)-8-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
7-(4-bromophenyl)-8-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
7-(4-bromophenyl)-8-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 3335-0877 |
| Compound Name: | 7-(4-bromophenyl)-8-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 560.41 |
| Molecular Formula: | C26 H22 Br N7 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)N1C(=Cn2c3C(N(C)C(N(C)c3nc12)=O)=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5401 |
| logD: | 3.5401 |
| logSw: | -3.5781 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.443 |
| InChI Key: | MKPJLYBKIZFANQ-UHFFFAOYSA-N |