ethyl 2-{[3,5-bis(trifluoromethyl)benzoyl]imino}-1-(3-methoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[3,5-bis(trifluoromethyl)benzoyl]imino}-1-(3-methoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-{[3,5-bis(trifluoromethyl)benzoyl]imino}-1-(3-methoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0755 |
| Compound Name: | ethyl 2-{[3,5-bis(trifluoromethyl)benzoyl]imino}-1-(3-methoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 596.49 |
| Molecular Formula: | C27 H22 F6 N4 O5 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CCCOC)C\1=N/C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9899 |
| logD: | 3.9897 |
| logSw: | -4.1918 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.287 |
| InChI Key: | MOFGMXFDLXPZNQ-UHFFFAOYSA-N |