7-[(3-chlorophenyl)methyl]-3-(2-methoxyphenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(3-chlorophenyl)methyl]-3-(2-methoxyphenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(3-chlorophenyl)methyl]-3-(2-methoxyphenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-6199 |
| Compound Name: | 7-[(3-chlorophenyl)methyl]-3-(2-methoxyphenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 452.94 |
| Molecular Formula: | C24 H25 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CCN1C(c2c(ncn2Cc2cccc(c2)[Cl])N(C1=O)c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4992 |
| logD: | 4.4992 |
| logSw: | -4.5983 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.854 |
| InChI Key: | WKGFUENDQSJDIW-UHFFFAOYSA-N |