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N-Desmethyl Lumateperone

CAT: 1459-CS-O-35163Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-35163Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
N-Desmethyl Lumateperone is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Lumateperone. The product is supplied by Clearsynth under CAT No. CS-O-35163. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
313368-82-0
Synonyms
N-Desmethyl Lumateperone
Molecular Formula
C 23 H 26 FN 3 O
Molecular Weight
379.5
Additionnal Information
N-Desmethyl Lumateperone is supplied with detailed characterization data compliant with regulatory guideline. N-Desmethyl Lumateperone can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Lumateperone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Lumateperone N-Desmethyl
CAS Number313368-82-0
PubChem CID21302486
IUPAC Name1-(4-fluorophenyl)-4-[(10R,15S)-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]butan-1-one
Molecular FormulaC23H26FN3O
Molecular Weight379.5
XLogP3.6
Topological Polar Surface Area35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity564
SMILES
C1CN(C[C@@H]2[C@H]1N3CCNC4=CC=CC2=C43)CCCC(=O)C5=CC=C(C=C5)F
InChI
InChI=1S/C23H26FN3O/c24-17-8-6-16(7-9-17)22(28)5-2-12-26-13-10-21-19(15-26)18-3-1-4-20-23(18)27(21)14-11-25-20/h1,3-4,6-9,19,21,25H,2,5,10-15H2/t19-,21-/m0/s1
InChIKey
WPJSNLWFVMFFSG-FPOVZHCZSA-N
Chemical Structure
2D Structure
2D structure of Lumateperone N-Desmethyl
CAS: 313368-82-0
CID: 21302486
Formula: C23H26FN3O
MW: 379.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight379.5
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass379.20599062
Monoisotopic Mass379.20599062
Topological Polar Surface Area35.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity564
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-L07935-01N-Desmethyl Lumateperone N-Glucuronide
AR-L07938-01Desmethyl Lumateperone Impurity
TRC-D862990-25MGN-Desmethyl-N-(1-(4-fluorophenyl)butan-1-one) Lumateperone
TRC-L753880-50MGLumateperone N-Oxide
AR-L06225-01Lumateperone N-ethylacetate Impurity
AR-L07928-01N-Nitroso Lumateperone Impurity 25
AR-L07932-01N-Nitroso Lumateperone Impurity 14
AR-L06234-01Lumateperone N-Ethyl Ester Impurity
AR-L07945-01N-Nitroso Lumateperone Impurity 6 Tosylate
AR-L07950-01N-Nitroso Lumateperone Impurity 6 Enantiomer Tosylate

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