7-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | V018-9935 |
Compound Name: | 7-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-3-(2-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 440.89 |
Molecular Formula: | C22 H21 Cl N4 O4 |
Smiles: | COCCN1C(c2c(ncn2Cc2ccccc2[Cl])N(C1=O)c1ccccc1OC)=O |
Stereo: | ACHIRAL |
logP: | 2.7345 |
logD: | 2.7345 |
logSw: | -3.223 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 58.196 |
InChI Key: | WOUFGLFPOBLWDQ-UHFFFAOYSA-N |