3-(2-chlorophenyl)-1-(3-methylbutyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-1-(3-methylbutyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-1-(3-methylbutyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0608 |
| Compound Name: | 3-(2-chlorophenyl)-1-(3-methylbutyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 452.94 |
| Molecular Formula: | C24 H25 Cl N4 O3 |
| Smiles: | CC(C)CCN1C(c2c(ncn2CCOc2ccccc2)N(C1=O)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6086 |
| logD: | 4.6086 |
| logSw: | -4.4627 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.62 |
| InChI Key: | FXJINLIEQRHWRI-UHFFFAOYSA-N |