methyl 5-({3-(2-methylphenyl)-2,6-dioxo-1-[(oxolan-2-yl)methyl]-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({3-(2-methylphenyl)-2,6-dioxo-1-[(oxolan-2-yl)methyl]-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
methyl 5-({3-(2-methylphenyl)-2,6-dioxo-1-[(oxolan-2-yl)methyl]-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate
Compound characteristics
| Compound ID: | V020-6444 |
| Compound Name: | methyl 5-({3-(2-methylphenyl)-2,6-dioxo-1-[(oxolan-2-yl)methyl]-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)furan-2-carboxylate |
| Molecular Weight: | 464.48 |
| Molecular Formula: | C24 H24 N4 O6 |
| Smiles: | Cc1ccccc1N1C(N(CC2CCCO2)C(c2c1ncn2Cc1ccc(C(=O)OC)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1956 |
| logD: | 2.1956 |
| logSw: | -2.3411 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.643 |
| InChI Key: | NETFLVIAXCJBFN-MRXNPFEDSA-N |