3-(3-chlorophenyl)-7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3,7-dihydro-1H-purine-2,6-dione
3-(3-chlorophenyl)-7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V017-7745 |
| Compound Name: | 3-(3-chlorophenyl)-7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 388.85 |
| Molecular Formula: | C19 H21 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2CC(C(C)(C)C)=O)N(C1=O)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7902 |
| logD: | 2.7902 |
| logSw: | -3.1678 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.789 |
| InChI Key: | GKCRISKRUXHILO-UHFFFAOYSA-N |