7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V027-6718 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutyl)-1-ethyl-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 384.43 |
| Molecular Formula: | C20 H24 N4 O4 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2CC(C(C)(C)C)=O)N(C1=O)c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.01 |
| logD: | 2.01 |
| logSw: | -2.2669 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.119 |
| InChI Key: | HNDJDRFQVKDEHI-UHFFFAOYSA-N |