8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 3238-0072 |
Compound Name: | 8-[(3-methoxypropyl)amino]-1,3-dimethyl-7-[(4-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 371.44 |
Molecular Formula: | C19 H25 N5 O3 |
Smiles: | Cc1ccc(Cn2c3C(N(C)C(N(C)c3nc2NCCCOC)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.9175 |
logD: | 2.9174 |
logSw: | -3.1374 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.302 |
InChI Key: | JCMBOTRUDSTHIJ-UHFFFAOYSA-N |