3-(2-chlorophenyl)-7-[(2-methoxyphenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-7-[(2-methoxyphenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-7-[(2-methoxyphenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-7545 |
| Compound Name: | 3-(2-chlorophenyl)-7-[(2-methoxyphenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C22 H19 Cl N4 O3 |
| Smiles: | COc1ccccc1Cn1cnc2c1C(N(CC=C)C(N2c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4398 |
| logD: | 3.4398 |
| logSw: | -3.5008 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.854 |
| InChI Key: | OBSQODBGOWVQHI-UHFFFAOYSA-N |