ethyl 2-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]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-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]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: | C098-0620 |
| Compound Name: | ethyl 2-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 583.99 |
| Molecular Formula: | C30 H22 Cl N5 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccco2)C/1=N/C(c1c(c2ccccc2[Cl])noc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7221 |
| logD: | 3.7208 |
| logSw: | -4.4395 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 99.403 |
| InChI Key: | CYMXVADLTYKPPM-UHFFFAOYSA-N |