1-[(4-bromophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-[(4-bromophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
1-[(4-bromophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7282-5578 |
| Compound Name: | 1-[(4-bromophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 471.31 |
| Molecular Formula: | C21 H19 Br N4 O4 |
| Smiles: | CN1C(N(Cc2ccc(cc2)[Br])C(c2c1nc(n2C)Oc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3948 |
| logD: | 4.3948 |
| logSw: | -4.4693 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.34 |
| InChI Key: | IWGCCEFGJFBUIB-UHFFFAOYSA-N |