1-(2-methoxyethyl)-3-(3-methoxyphenyl)-7-[(3-nitrophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(2-methoxyethyl)-3-(3-methoxyphenyl)-7-[(3-nitrophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1-(2-methoxyethyl)-3-(3-methoxyphenyl)-7-[(3-nitrophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V028-5561 |
| Compound Name: | 1-(2-methoxyethyl)-3-(3-methoxyphenyl)-7-[(3-nitrophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 451.44 |
| Molecular Formula: | C22 H21 N5 O6 |
| Salt: | not_available |
| Smiles: | COCCN1C(c2c(ncn2Cc2cccc(c2)[N+]([O-])=O)N(C1=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2528 |
| logD: | 2.2528 |
| logSw: | -2.5086 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.792 |
| InChI Key: | GEAIQHLLCJTDTR-UHFFFAOYSA-N |