ethyl 2-[(5-bromo-2-chlorobenzoyl)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-[(5-bromo-2-chlorobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(5-bromo-2-chlorobenzoyl)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: | C098-0688 |
| Compound Name: | ethyl 2-[(5-bromo-2-chlorobenzoyl)imino]-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 585.84 |
| Molecular Formula: | C26 H22 Br Cl N4 O5 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC2CCCO2)C/1=N/C(c1cc(ccc1[Cl])[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5868 |
| logD: | 3.5868 |
| logSw: | -3.9448 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.349 |
| InChI Key: | CWNYWYCIQVXSKD-MRXNPFEDSA-N |