methyl 5-{[1-benzyl-3-(2-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[1-benzyl-3-(2-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
methyl 5-{[1-benzyl-3-(2-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | V020-6358 |
| Compound Name: | methyl 5-{[1-benzyl-3-(2-methoxyphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]methyl}furan-2-carboxylate |
| Molecular Weight: | 486.48 |
| Molecular Formula: | C26 H22 N4 O6 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(Cn2cnc3c2C(N(Cc2ccccc2)C(N3c2ccccc2OC)=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.186 |
| logD: | 3.186 |
| logSw: | -3.3315 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.619 |
| InChI Key: | MKHMJKYGZRQYJN-UHFFFAOYSA-N |