ethyl 2-[(2-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-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-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: | C098-0639 |
| Compound Name: | ethyl 2-[(2-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: | 517.5 |
| Molecular Formula: | C26 H23 N5 O7 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC2CCCO2)C/1=N/C(c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6191 |
| logD: | 1.619 |
| logSw: | -2.4427 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.429 |
| InChI Key: | MQUAMMNMWHVCPJ-MRXNPFEDSA-N |