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[7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide structure
Fine Chemical

[7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide

TL;DR: [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide (CAS 1052406-03-7) is a chemical compound with molecular formula C19H18Br2ClN3O3 and molecular weight 528.94037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate;hydrobromide

Also Known As: [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide, [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate;hydrobromide, 7-bromo-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-3-yl 4-aminobutanoate hydrobromide, 7-bromo-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl 4-aminobutanoate hydrobromide

CAS Number
1052406-03-7
Molecular Formula
C19H18Br2ClN3O3
Molecular Weight
528.94037 g/mol
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Technical Specifications

Molecular FormulaC19H18Br2ClN3O3
Molecular Weight528.94037 g/mol
XLogP4.0781
Topological Polar Surface Area (TPSA)93.8 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass528.94037 Da
Heavy Atoms28
Complexity589.0
SMILESC1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Br)OC(=O)CCCN)Cl.Br
InChIKeyUBSHRRXBQVFHLS-UHFFFAOYSA-N

Chemical Property Profile of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide

XLogP
4.0781
TPSA (Topological Polar Surface Area)
93.8
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
28
Complexity
589.0
Exact Mass
528.94037
Monoisotopic Mass
528.94037
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide

The XLogP value of 4.0781 indicates that [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide. Following Lipinski's Rule of Five, [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide?

The CAS number of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide is 1052406-03-7.

What is the molecular formula of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide?

The molecular formula of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide is C19H18Br2ClN3O3.

What is the molecular weight of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide?

The molecular weight of [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide is 528.94037 g/mol.

Where can I buy [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide?

You can request a quote for [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide?

Yes, CoreyChem provides custom synthesis services for [7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl] 4-aminobutanoate hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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