3-(4-chlorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0924 |
| Compound Name: | 3-(4-chlorophenyl)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 494.93 |
| Molecular Formula: | C25 H23 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Cn1cnc2c1C(N(CC1CCCO1)C(N2c1ccc(cc1)[Cl])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7853 |
| logD: | 2.7853 |
| logSw: | -3.4153 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.719 |
| InChI Key: | CNSUIRFUNSVHTN-HXUWFJFHSA-N |