ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-1-(2-methylpropyl)-5-oxo-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]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0314 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 488.5 |
| Molecular Formula: | C26 H24 N4 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC(C)C)C/1=N/C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1669 |
| logD: | 3.1668 |
| logSw: | -3.2535 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.081 |
| InChI Key: | JKCIVGLSPXKVRL-UHFFFAOYSA-N |