8-{[(3-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[(3-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{[(3-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | Y600-2816 |
| Compound Name: | 8-{[(3-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 315.33 |
| Molecular Formula: | C15 H17 N5 O3 |
| Smiles: | CN1C(c2c(nc(NCc3cccc(c3)OC)[nH]2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5418 |
| logD: | 1.5399 |
| logSw: | -1.9406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.988 |
| InChI Key: | QEAFODNOVJGIJM-UHFFFAOYSA-N |