ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0773 |
| Compound Name: | ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 560.99 |
| Molecular Formula: | C29 H25 Cl N4 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccco2)C\1=N/C(C(C)(C)Oc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2491 |
| logD: | 4.2233 |
| logSw: | -4.5974 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.663 |
| InChI Key: | AJLGKYDWRRZJSN-UHFFFAOYSA-N |