7-[(2-chlorophenyl)methyl]-1-ethyl-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-1-ethyl-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-1-ethyl-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V019-9718 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-1-ethyl-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 394.86 |
| Molecular Formula: | C21 H19 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2Cc2ccccc2[Cl])N(C1=O)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7516 |
| logD: | 3.7516 |
| logSw: | -3.7897 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.271 |
| InChI Key: | RGLCRGLXLYNAFM-UHFFFAOYSA-N |