Structure
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Relationships |
Total Number of functionally related protein(s) :
3
Total Number of Articles : 4
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PubChem |
9918381
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Molecular Formula |
C40H38F5N3O3S |
SMILES |
COCCN1CCC(CC1)N(CC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)CN4C5=CC=CC=C5C(=O)C=C4SCC6=C(C(=CC=C6)F)F |
InChI |
InChI=1S/C40H38F5N3O3S/c1-51-22-21-46-19-17-32(18-20-46)47(24-27-9-11-28(12-10-27)29-13-15-31(16-14-29)40(43,44)45)37(50)25-48-35-8-3-2-6-33(35)36(49)23-38(48)52-26-30-5-4-7-34(41)39(30)42/h2-16,23,32H,17-22,24-26H2,1H3 |
synonyms |
- Rilapladib
- 412950-08-4
- Rilapladib (USAN)
- SB-659032
- Rilapladib [USAN:INN]
- SB 659032
- UNII-O14CWE893Z
- O14CWE893Z
- RILAPLADIB [INN]
- RILAPLADIB [USAN]
- 2-[2-[(2,3-difluorophenyl)methylsulfanyl]-4-oxoquinolin-1-yl]-N-[1-(2-methoxyethyl)piperidin-4-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide
- DTXSID50194281
- 2-(2-((2,3-Difluorobenzyl)sulfanyl)-4-oxoquinolin-1(4H)-yl)-N-(1-(2-methoxyethyl)piperidin-4-yl)-N-((4'-(trifluoromethyl)biphenyl-4-yl)methyl)acetamide
- rilapladibum
- 2-(2-(((2,3-difluorophenyl)methyl)sulfanyl)-4-oxo-1,4-dihydroquinolin-1-yl)-N-(1-(2-methoxyethyl)piperidin-4-yl)-N-((4'-(trifluoromethyl)-(1,1'-biphenyl)-4-yl)methyl)acetamide
- 2-(2-((2,3-difluorophenyl)methylsulfanyl)-4-oxoquinolin-1-yl)-N-(1-(2-methoxyethyl)piperidin-4-yl)-N-((4-(4-(trifluoromethyl)phenyl)phenyl)methyl)acetamide
- 2-(2-{[(2,3-difluorophenyl)methyl]sulfanyl}-4-oxo-1,4-dihydroquinolin-1-yl)-N-[1-(2-methoxyethyl)piperidin-4-yl]-N-{[4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl]methyl}acetamide
- DTXCID60116772
- 2-[[(2,3-Difluorophenyl)methyl]thio]-N-[1-(2-methoxyethyl)-4-piperidinyl]-4-oxo-N-[[4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]methyl]-1(4H)-quinolineacetamide
- GTPL7376
- SCHEMBL2801812
- CHEMBL2104981
- NNBGCSGCRSCFEA-UHFFFAOYSA-N
- GLXC-10594
- HMS3751I15
- BCP31473
- EX-A5756
- BDBM50205805
- AKOS027250919
- DB05119
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Properties |
Property |
Value |
MW |
735.8 g/mol |
HBD |
0 |
HBA |
11 |
Rotatable Bond Count |
12 |
Exact Mass |
735.25540407 g/mol |
Monoisotopic Mass |
735.25540407 g/mol |
Heavy Atom Count |
52 |
Isotope Atom Count |
0 |
Atom Stereo Count |
0 |
Covalent Unit Count |
1 |
Complexity |
1200 |
xlogp |
8.1 |
Topological Polar Surface Area |
78.4 |
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