ethyl {3-(3-chlorophenyl)-1-[(3-methoxyphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Chemical Structure Depiction of
ethyl {3-(3-chlorophenyl)-1-[(3-methoxyphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
ethyl {3-(3-chlorophenyl)-1-[(3-methoxyphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Compound characteristics
| Compound ID: | V024-0888 |
| Compound Name: | ethyl {3-(3-chlorophenyl)-1-[(3-methoxyphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate |
| Molecular Weight: | 468.9 |
| Molecular Formula: | C23 H21 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | CCOC(Cn1cnc2c1C(N(Cc1cccc(c1)OC)C(N2c1cccc(c1)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1945 |
| logD: | 3.1945 |
| logSw: | -3.2315 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.248 |
| InChI Key: | GTLOEFQALOPGMY-UHFFFAOYSA-N |