ethyl 2-[(2-methyl-3-nitrobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-methyl-3-nitrobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(2-methyl-3-nitrobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0669 |
| Compound Name: | ethyl 2-[(2-methyl-3-nitrobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 531.52 |
| Molecular Formula: | C27 H25 N5 O7 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC2CCCO2)C/1=N/C(c1cccc(c1C)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.433 |
| logD: | 2.4329 |
| logSw: | -2.719 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.429 |
| InChI Key: | PIRDNQFXEZMXHH-QGZVFWFLSA-N |