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2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one structure
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2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one

TL;DR: 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one (CAS 142273-19-6) is a chemical compound with molecular formula C16H11BrN2O and molecular weight 326.0055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one

Also Known As: 2-Bromopaullone, Paullone Analog 16, 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one, NCI60_013827, 2-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one

CAS Number
142273-19-6
Molecular Formula
C16H11BrN2O
Molecular Weight
326.0055 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (13 patents) Pharmaceutical Intermediates (13 patents)

Technical Specifications

Molecular FormulaC16H11BrN2O
Molecular Weight326.0055 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)44.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass326.0055 Da
Heavy Atoms20
Complexity402.0
SMILESC1C2=C(C3=C(C=CC(=C3)Br)NC1=O)NC4=CC=CC=C24
InChIKeyIEEQWYMIVLKPFP-UHFFFAOYSA-N

Chemical Property Profile of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one

XLogP
3.3
TPSA (Topological Polar Surface Area)
44.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
20
Complexity
402.0
Exact Mass
326.0055
Monoisotopic Mass
326.0055
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 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one

The XLogP value of 3.3 indicates that 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.9 Ų, 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one?

The CAS number of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one is 142273-19-6.

What is the molecular formula of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one?

The molecular formula of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one is C16H11BrN2O.

What is the molecular weight of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one?

The molecular weight of 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one is 326.0055 g/mol.

Where can I buy 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one?

You can request a quote for 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one?

Yes, CoreyChem provides custom synthesis services for 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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