7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 8015-9032 |
Compound Name: | 7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 411.46 |
Molecular Formula: | C21 H25 N5 O4 |
Smiles: | CN1C(c2c(nc(N3CCCCC3)n2CC(c2ccc(cc2)OC)=O)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0088 |
logD: | 3.0088 |
logSw: | -3.1955 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 66.488 |
InChI Key: | SQSYEEJQSVKUJX-UHFFFAOYSA-N |