ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0107 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 474.47 |
| Molecular Formula: | C25 H22 N4 O6 |
| Smiles: | CCCN1C2=C(C=C(/C1=N/C(c1ccc3c(c1)OCO3)=O)C(=O)OCC)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.715 |
| logD: | 2.7147 |
| logSw: | -2.8946 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.06 |
| InChI Key: | LLRWYHGNUNIZEP-UHFFFAOYSA-N |