ethyl 1-butyl-2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-butyl-2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 1-butyl-2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0723 |
| Compound Name: | ethyl 1-butyl-2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]imino}-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 537.02 |
| Molecular Formula: | C28 H29 Cl N4 O5 |
| Smiles: | CCCCN1C2=C(C=C(\C1=N/C(C(C)(C)Oc1ccc(cc1)[Cl])=O)C(=O)OCC)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6573 |
| logD: | 4.6547 |
| logSw: | -4.7343 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.164 |
| InChI Key: | YJRZJHLSWBUHCS-UHFFFAOYSA-N |