ethyl 1-butyl-5-oxo-2-[(3-phenylprop-2-enoyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-butyl-5-oxo-2-[(3-phenylprop-2-enoyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 1-butyl-5-oxo-2-[(3-phenylprop-2-enoyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0218 |
| Compound Name: | ethyl 1-butyl-5-oxo-2-[(3-phenylprop-2-enoyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 470.53 |
| Molecular Formula: | C27 H26 N4 O4 |
| Smiles: | CCCCN1C2=C(C=C(/C1=N/C(/C=C/c1ccccc1)=O)C(=O)OCC)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8657 |
| logD: | 3.8656 |
| logSw: | -3.9535 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.731 |
| InChI Key: | JZUOTJCNVLSMBY-UHFFFAOYSA-N |