ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]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-(4-chlorophenoxy)-2-methylpropanoyl]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-(4-chlorophenoxy)-2-methylpropanoyl]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: | C098-0783 |
| Compound Name: | ethyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-5-oxo-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 565.03 |
| Molecular Formula: | C29 H29 Cl N4 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC2CCCO2)C\1=N/C(C(C)(C)Oc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4385 |
| logD: | 3.4376 |
| logSw: | -3.9644 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.568 |
| InChI Key: | XOHHMBFMQPOGLY-HXUWFJFHSA-N |