ethyl 2-[(3-bromobenzoyl)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-[(3-bromobenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(3-bromobenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0299 |
| Compound Name: | ethyl 2-[(3-bromobenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 523.39 |
| Molecular Formula: | C25 H23 Br N4 O4 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC(C)C)C/1=N/C(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0934 |
| logD: | 4.0932 |
| logSw: | -4.1751 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.966 |
| InChI Key: | RJABCMVDFHEDCG-UHFFFAOYSA-N |