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Structure
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| Relationships |
Total Number of functionally related protein(s) :
18
Total Number of Articles : 19
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| PubChem |
6437380
|
| Molecular Formula |
C30H32Cl3NO |
| SMILES |
CCCCN(CCCC)CC(C1=CC(=CC\2=C1C3=C(/C2=C/C4=CC=C(C=C4)Cl)C=C(C=C3)Cl)Cl)O |
| InChI |
InChI=1S/C30H32Cl3NO/c1-3-5-13-34(14-6-4-2)19-29(35)28-18-23(33)17-27-25(15-20-7-9-21(31)10-8-20)26-16-22(32)11-12-24(26)30(27)28/h7-12,15-18,29,35H,3-6,13-14,19H2,1-2H3/b25-15- |
| synonyms |
- Lumefantrine
- Benflumetol
- 82186-77-4
- dl-Benflumelol
- Lumefantrine, (+)-
- Lumefantrine, (-)-
- (Z)-2-(Dibutylamino)-1-(2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl)ethanol
- benflumelol
- D-Benflumelol
- L-Benflumelol
- GNF-Pf-1971
- 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]fluoren-4-yl]ethanol
- 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl]ethan-1-ol
- CPG-56695
- ZUV4B00D9P
- (+-)-2,7-Dichloro-9-((Z)-p-chlorobenzylidene)-alpha-((dibutylamino)methyl)fluorene-4-methanol
- 01NP22J3SV
- 120583-70-2
- 120583-71-3
- DTXSID3046663
- CHEBI:156095
- F38R0JR742
- MFCD05662268
- (9Z)-2,7-Dichloro-9-[(4-chlorophenyl)methylene]-alpha-[(dibutylamino)methyl]-9H-fluorene-4-methanol
- NCGC00167490-01
- 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol
- 2-Dibutylamino-1-[2,7-dichloro-9-(4-chloro-benzylidene)-9H-fluoren-4-yl]-ethanol
- 2-Dibutylamino-1-{2,7-dichloro-9-[1-(4-chloro-phenyl)-meth-(Z)-ylidene]-9H-fluoren-4-yl}-ethanol
- 9H-Fluorene-4-methanol, 2,7-dichloro-9-((4-chlorophenyl)methylene)-alpha-((dibutylamino)methyl)-, (9Z)-(+)-
- 9H-Fluorene-4-methanol, 2,7-dichloro-9-((4-chlorophenyl)methylene)-alpha-((dibutylamino)methyl)-, (9Z)-(-)-
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| Properties |
| Property |
Value |
| MW |
528.9 g/mol |
| HBD |
1 |
| HBA |
2 |
| Rotatable Bond Count |
10 |
| Exact Mass |
527.154948 g/mol |
| Monoisotopic Mass |
527.154948 g/mol |
| Heavy Atom Count |
35 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
1 |
| Covalent Unit Count |
1 |
| Complexity |
671 |
| xlogp |
8.7 |
| Topological Polar Surface Area |
23.5 |
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