8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 5339-0455 |
Compound Name: | 8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 371.44 |
Molecular Formula: | C19 H25 N5 O3 |
Smiles: | Cc1ccccc1Cn1c2C(N(C)C(N(C)c2nc1NCCCOC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2505 |
logD: | 3.25 |
logSw: | -3.1864 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.302 |
InChI Key: | KLTAIBJTUGTKRH-UHFFFAOYSA-N |