7-[(4-tert-butylphenyl)methyl]-1-cyclopropyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methyl]-1-cyclopropyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-tert-butylphenyl)methyl]-1-cyclopropyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-8430 |
| Compound Name: | 7-[(4-tert-butylphenyl)methyl]-1-cyclopropyl-3-(3-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C26 H28 N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)N1C(N(C2CC2)C(c2c1ncn2Cc1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1103 |
| logD: | 5.1103 |
| logSw: | -5.0214 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.827 |
| InChI Key: | KFUXQWFKNRRGQN-UHFFFAOYSA-N |