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N-(Piperidin-4-yl)-4'-(trifluoromethyl)-biphenyl-2-carboxamide

HCID 9928271
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
182439-41-4
Standard SMILES
O=C(NC1CCNCC1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIKey
AQANXBKFOZBCIY-UHFFFAOYSA-N
Molecular formula
C19H19F3N2O
Average molar mass
348.4 g/mol

Names & identifiers

Preferred name
N-(Piperidin-4-yl)-4'-(trifluoromethyl)-biphenyl-2-carboxamide
IUPAC
N-piperidin-4-yl-2-[4-(trifluoromethyl)phenyl]benzamide
English name
N-(piperidin-4-yl)-4'-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamide
Molecular formula
C19H19F3N2O
Molecular weight
348.36

Names & synonyms

182439-41-4N-(Piperidin-4-yl)-4'-(trifluoromethyl)-biphenyl-2-carboxamideLomitapide metabolite M1BP7YFS63H2UNII-BP7YFS63H2N-4-Piperidinyl-4'-(trifluoromethyl)(1,1'-biphenyl)-2-carboxamide(1,1'-Biphenyl)-2-carboxamide, N-4-piperidinyl-4'-(trifluoromethyl)-[1,1'-Biphenyl]-2-carboxamide, N-4-piperidinyl-4'-(trifluoromethyl)-RefChem:202045N-(Piperidin-4-yl)-4'-(trifluoromethyl)biphenyl-2-carboxamideN-(PIPERIDIN-4-YL)-4'-(TRIFLUOROMETHYL)-[1,1'-BIPHENYL]-2-CARBOXAMIDEN-piperidin-4-yl-2-[4-(trifluoromethyl)phenyl]benzamide
Show more names
N-4-Piperidinyl-4'-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamideN-(piperidin-4-yl)-4'-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamideethyl)-[1,1'-biphenyl]-2-carboxamido)piperidin-1-yl)butyl)-9H-fluorene-9-carboxamide
MFCD27978680N-(piperidin-4-yl)-4-(trifluoromethyl)biphenyl-2-carboxamideLomitapide M1SCHEMBL593798orb3218332DB-4034494-(4'-Trifluoromethylbiphenyl-2-carbonylamino)piperidineN-(4-Piperidinyl)-4'-(trifluoromethyl)-2-biphenylcarboxamide

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
41.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Formal charge
0
Complexity
440

Physicochemical properties

Boiling point
480.8 · 480.8±45.0 °C(Predicted)
Density
1.27 · 1.27±0.1 g/cm3(Predicted)
storage temp.
Store at Room Tem.
pka
14.06 · 14.06±0.20(Predicted)
FDA UNII
7 YFS63H2 · BP7YFS63H2
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
303 · H303-H320
Precautionary statements
312 · P312-P264-P305+P351+P338-P337+P313
HS Code
2933399990 · 2933399990

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H303-H320
Precautionary statements
P312-P264-P305+P351+P338-P337+P313

Chemistry & industry

Applications · 1 item

UsesN-(Piperidin-4-yl)-4''-(trifluoromethyl)-biphenyl-2-carboxamide is a reagent used in the preparation of lomitapide mesylate crystal forms. Lomitapide mesylate is a microsomal triglyceride transfer protein inhibitor which can lower the level of low density lipoprotein cholesterol in plasma. Lomitapide (L469435) metabolite.

Suppliers12 total

艾琪康医药科技(上海)有限公司13661411401 · [email protected]
北京康派森医药科技有限公司010-010-52878169 15801002657 · [email protected]
海思化医药科技(北京)有限公司010-52980412 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
湖南和众医药科技有限公司027-87614241 3310618156 · [email protected]
艾琪康医药科技(上海)有限公司13512160998; 13512160998 · [email protected]
西安瑞谱源生物技术有限公司18192620610
北京佰康和诺科技有限公司010-57296878 15633144420 · [email protected]
郑州凡尔赛特化工有限公司0371-67991738 13783628208 · [email protected]
艾览(上海)化工科技有限公司400-668-9898 · [email protected]

Related reactions

10 records
New reaction record
HRID 494402 reaction equation
HRID 494402As productuspto-grants-2009_05
HRID 494403 reaction equation
HRID 494403As reactantuspto-grants-2009_05
HRID 950874 reaction equation
HRID 950874As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1167099 reaction equation
HRID 1167099As productuspto-grants-2003_09
HRID 1167100 reaction equation
HRID 1167100As reactantuspto-grants-2003_09
HRID 1167102 reaction equation
HRID 1167102As reactantuspto-grants-2003_09
HRID 1167103 reaction equation
HRID 1167103As reactantuspto-grants-2003_09
HRID 1167111 reaction equation
HRID 1167111As reactantuspto-grants-2003_09
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
182439-41-4
PubChem CID
9928271
UNII
BP7YFS63H2
欧柏科思生物医药研究所(常州)有限公司0519-85138626 19952801683 · [email protected]