![6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione structure](/static/products/5338/533868-19-8.webp)
6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione
TL;DR: 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione (CAS 533868-19-8) is a chemical compound with molecular formula C21H14ClNO2 and molecular weight 347.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chloro-4-methylphenyl)benzo[d][2]benzazepine-5,7-dione
Also Known As: F0555-0119, 6-(3-chloro-4-methylphenyl)benzo[d][2]benzazepine-5,7-dione, 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione
| Molecular Formula | C21H14ClNO2 |
|---|---|
| Molecular Weight | 347.07 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 347.07132 |
| Heavy Atoms | 25 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 533868-19-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C4=CC=CC=C4C2=O)Cl |
| InChIKey | TXZXVKROSZRFPF-UHFFFAOYSA-N |
Product Overview
6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione (CAS 533868-19-8), with molecular formula C21H14ClNO2 and molecular weight 347.07 g/mol. IUPAC: 6-(3-chloro-4-methylphenyl)benzo[d][2]benzazepine-5,7-dione.
Chemical Property Profile of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione
Property Insights of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione
The XLogP value of 5.1 indicates that 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione?
The CAS number of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione is 533868-19-8.
What is the molecular formula of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione?
The molecular formula of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione is C21H14ClNO2.
What is the molecular weight of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione?
The molecular weight of 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione is 347.07 g/mol.
Where can I buy 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione?
You can request a quote for 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-chloro-4-methylphenyl)-5H-dibenzo[c,e]azepine-5,7(6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.