ethyl 1-[(furan-2-yl)methyl]-2-[(3-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[(furan-2-yl)methyl]-2-[(3-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 1-[(furan-2-yl)methyl]-2-[(3-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0569 |
| Compound Name: | ethyl 1-[(furan-2-yl)methyl]-2-[(3-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 513.47 |
| Molecular Formula: | C26 H19 N5 O7 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccco2)C/1=N/C(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8045 |
| logD: | 2.8033 |
| logSw: | -3.0772 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 110.825 |
| InChI Key: | YYMNIVJGSZGKRI-UHFFFAOYSA-N |