3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0166 |
| Compound Name: | 3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 491.8 |
| Molecular Formula: | C23 H21 Cl3 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CCN1C(c2c(ncn2Cc2ccc(c(c2)[Cl])[Cl])N(C1=O)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.79 |
| logD: | 5.79 |
| logSw: | -5.9189 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.223 |
| InChI Key: | NRPPRUCITYLBDP-UHFFFAOYSA-N |