1,3-dimethyl-7-[(3-methylphenyl)methyl]-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-[(3-methylphenyl)methyl]-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-[(3-methylphenyl)methyl]-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0242 |
| Compound Name: | 1,3-dimethyl-7-[(3-methylphenyl)methyl]-8-[(piperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 381.48 |
| Molecular Formula: | C21 H27 N5 O2 |
| Smiles: | Cc1cccc(Cn2c3C(N(C)C(N(C)c3nc2CN2CCCCC2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.396 |
| logD: | 3.3676 |
| logSw: | -3.5315 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.413 |
| InChI Key: | JZRQUGPMJCTWNL-UHFFFAOYSA-N |