Lomitapide mesylate 50mg

CAT: 0628-A16600-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A16600-50Size:50 mg

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CAS Number

202914-84-9

Chemical Information

Lomitapide Mesylate

Lomitapide mesylate is a methanesulfonate (mesylate) salt prepared from equimolar amounts of lomitapide and methanesulfonic acid. Used as a complement to a low-fat diet and other lipid-lowering treatments in patients with homozygous familial hypercholesterolemia. It has a role as an anticholesteremic drug and a MTP inhibitor. It contains a lomitapide(1+).

CAS Number	202914-84-9
PubChem CID	11274333
IUPAC Name	methanesulfonic acid;N-(2,2,2-trifluoroethyl)-9-[4-[4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]piperidin-1-yl]butyl]fluorene-9-carboxamide
Molecular Formula	C40H41F6N3O5S
Molecular Weight	789.8
Topological Polar Surface Area	124
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	10
Heavy Atom Count	55
Formal Charge	0
Complexity	1200

SMILES

CS(=O)(=O)O.C1CN(CCC1NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)CCCCC4(C5=CC=CC=C5C6=CC=CC=C64)C(=O)NCC(F)(F)F

InChI

InChI=1S/C39H37F6N3O2.CH4O3S/c40-38(41,42)25-46-36(50)37(33-13-5-3-10-30(33)31-11-4-6-14-34(31)37)21-7-8-22-48-23-19-28(20-24-48)47-35(49)32-12-2-1-9-29(32)26-15-17-27(18-16-26)39(43,44)45;1-5(2,3)4/h1-6,9-18,28H,7-8,19-25H2,(H,46,50)(H,47,49);1H3,(H,2,3,4)

InChIKey

QKVKOFVWUHNEBX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 202914-84-9

CID: 11274333

Formula: C40H41F6N3O5S

MW: 789.8

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	789.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	10
Exact Mass	789.26711156
Monoisotopic Mass	789.26711156
Topological Polar Surface Area	124 Å²
Heavy Atom Count	55
Formal Charge	0
Complexity	1200
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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M13157-01	Lomitapide Mesylate
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Lomitapide mesylate 50mg

Chemical Information

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