ethyl 2-[(2H-1,3-benzodioxole-5-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-[(2H-1,3-benzodioxole-5-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-[(2H-1,3-benzodioxole-5-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: | C098-0590 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-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: | 512.48 |
| Molecular Formula: | C27 H20 N4 O7 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccco2)C/1=N/C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7811 |
| logD: | 2.7798 |
| logSw: | -3.0554 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.559 |
| InChI Key: | ABXSCXYNROPWKN-UHFFFAOYSA-N |