methyl 5-({3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
methyl 5-({3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
Compound characteristics
| Compound ID: | V020-6420 |
| Compound Name: | methyl 5-({3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate |
| Molecular Weight: | 480.86 |
| Molecular Formula: | C23 H17 Cl N4 O6 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(Cn2cnc3c2C(N(Cc2ccco2)C(N3c2ccc(cc2)[Cl])=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1748 |
| logD: | 3.1748 |
| logSw: | -3.3454 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.038 |
| InChI Key: | ZQZSJSBECCDCJL-UHFFFAOYSA-N |