4,7,9-Tribromo-2-chloro-1-benzazepin-5-one
TL;DR: 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one (CAS 38314-36-2) is a chemical compound with molecular formula C10H3Br3ClNO and molecular weight 424.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,9-tribromo-2-chloro-1-benzazepin-5-one
Also Known As: 4,7,9-tribromo-2-chloro-1-benzazepin-5-one, 4,7,9-tribromo-2-chloro-5H-1-benzazepin-5-one
| Molecular Formula | C10H3Br3ClNO |
|---|---|
| Molecular Weight | 424.75 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 424.74533 |
| Heavy Atoms | 16 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 38314-36-2 |
|---|---|
| SMILES | C1=C(C=C(C2=C1C(=O)C(=CC(=N2)Cl)Br)Br)Br |
| InChIKey | HXCHUWOSSYVHBU-UHFFFAOYSA-N |
Product Overview
4,7,9-Tribromo-2-chloro-1-benzazepin-5-one (CAS 38314-36-2), with molecular formula C10H3Br3ClNO and molecular weight 424.75 g/mol. IUPAC: 4,7,9-tribromo-2-chloro-1-benzazepin-5-one.
Chemical Property Profile of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one
Property Insights of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one
The XLogP value of 4.4 indicates that 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.4 Ų, 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one?
The CAS number of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one is 38314-36-2.
What is the molecular formula of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one?
The molecular formula of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one is C10H3Br3ClNO.
What is the molecular weight of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one?
The molecular weight of 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one is 424.75 g/mol.
Where can I buy 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one?
You can request a quote for 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4,7,9-Tribromo-2-chloro-1-benzazepin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.