3-(4-chlorophenyl)-7-ethyl-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-ethyl-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-7-ethyl-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V015-8650 |
| Compound Name: | 3-(4-chlorophenyl)-7-ethyl-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 394.86 |
| Molecular Formula: | C21 H19 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CCn1cnc2c1C(N(CCc1ccccc1)C(N2c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5198 |
| logD: | 3.5198 |
| logSw: | -3.6816 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.249 |
| InChI Key: | IOSDCCJIPDAFOL-UHFFFAOYSA-N |