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Alprazolam EP Impurity H

CAT: 1459-CS-EN-00038Size: 1 EachDry Ice: NoHazardous: No
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Description
Alprazolam EP Impurity H is listed under Impurity and is intended for research and analytical applications. It is associated with Alprazolam. This is a controlled substance entry for enquiry only. Any possible supply discussion is subject to due diligence, certification, permits, documentation, intended end-use and applicable compliance review. This controlled substance entry is shown for qualified research enquiry and compliance review, with product information including CAS number, molecular formula, molecular weight and enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
2203515-05-1
Synonyms
Alprazolam EP Impurity H
Molecular Formula
C 34 H 27 Cl 2 N 7 O 2
Molecular Weight
636.5
Additionnal Information
Alprazolam EP Impurity H is a controlled substance reference entry. Enquiries are reviewed for organization details, intended end-use, certifications, permits, documentation and applicable legal requirements before any possible supply discussion.
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

bis((4-(2-benzoyl-4-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl)methyl)amine
CAS Number2203515-05-1
PubChem CID76971439
IUPAC Name[2-[3-[[[4-(2-benzoyl-4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]methylamino]methyl]-5-methyl-1,2,4-triazol-4-yl]-5-chlorophenyl]-phenylmethanone
Molecular FormulaC34H27Cl2N7O2
Molecular Weight636.5
XLogP5.9
Topological Polar Surface Area108
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Heavy Atom Count45
Formal Charge0
Complexity920
SMILES
CC1=NN=C(N1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CNCC4=NN=C(N4C5=C(C=C(C=C5)Cl)C(=O)C6=CC=CC=C6)C
InChI
InChI=1S/C34H27Cl2N7O2/c1-21-38-40-31(42(21)29-15-13-25(35)17-27(29)33(44)23-9-5-3-6-10-23)19-37-20-32-41-39-22(2)43(32)30-16-14-26(36)18-28(30)34(45)24-11-7-4-8-12-24/h3-18,37H,19-20H2,1-2H3
InChIKey
YRRVKIRCJAMXRC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of bis((4-(2-benzoyl-4-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl)methyl)amine
CAS: 2203515-05-1
CID: 76971439
Formula: C34H27Cl2N7O2
MW: 636.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight636.5
XLogP35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Exact Mass635.1603285
Monoisotopic Mass635.1603285
Topological Polar Surface Area108 Ų
Heavy Atom Count45
Formal Charge0
Complexity920
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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