methyl 2-({3-(3-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)-1,3-oxazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-({3-(3-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)-1,3-oxazole-4-carboxylate
methyl 2-({3-(3-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)-1,3-oxazole-4-carboxylate
Compound characteristics
| Compound ID: | V022-4628 |
| Compound Name: | methyl 2-({3-(3-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)-1,3-oxazole-4-carboxylate |
| Molecular Weight: | 509.88 |
| Molecular Formula: | C24 H17 Cl F N5 O5 |
| Salt: | not_available |
| Smiles: | COC(c1coc(Cn2cnc3c2C(N(Cc2ccc(cc2)F)C(N3c2cccc(c2)[Cl])=O)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9654 |
| logD: | 2.9654 |
| logSw: | -3.2762 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.854 |
| InChI Key: | SYFMCKWTXJNOCK-UHFFFAOYSA-N |