7-[(4-tert-butylphenyl)methyl]-1-ethyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methyl]-1-ethyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-tert-butylphenyl)methyl]-1-ethyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-6061 |
| Compound Name: | 7-[(4-tert-butylphenyl)methyl]-1-ethyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C25 H28 N4 O2 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2Cc2ccc(cc2)C(C)(C)C)N(C1=O)c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9727 |
| logD: | 4.9727 |
| logSw: | -4.6169 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.271 |
| InChI Key: | WPPNARPOPBNWFX-UHFFFAOYSA-N |