5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-
TL;DR: 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- (CAS 20426-62-4) is a chemical compound with molecular formula C17H14BrNO3S and molecular weight 390.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-(4-methylphenyl)sulfonyl-2H-1-benzazepin-5-one
Also Known As: 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-, 4-bromo-2,5-dihydro-1-(p-tolylsulfonyl)-1h-1-benzazepin-5-one, 4-bromo-1-(4-methylphenyl)sulfonyl-2H-1-benzazepin-5-one, 4-Bromo-2,5-dihydro-1-(p-tolylsulfonyl )-1h-1-benzazepin-5-one, 4-bromo-1-(4-methylbenzenesulfonyl)-2,5-dihydro-1H-1-benzazepin-5-one
| Molecular Formula | C17H14BrNO3S |
|---|---|
| Molecular Weight | 390.99 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.9878 |
| Heavy Atoms | 23 |
| Complexity | 587.0 |
Chemical Identifiers
| CAS Number | 20426-62-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC=C(C(=O)C3=CC=CC=C32)Br |
| InChIKey | MGGZBCXWMPOPKP-UHFFFAOYSA-N |
Product Overview
5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- (CAS 20426-62-4), with molecular formula C17H14BrNO3S and molecular weight 390.99 g/mol. IUPAC: 4-bromo-1-(4-methylphenyl)sulfonyl-2H-1-benzazepin-5-one.
Chemical Property Profile of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-
Property Insights of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-
The XLogP value of 3.8 indicates that 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-. Following Lipinski's Rule of Five, 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- has 0 hydrogen bond donor(s) and 4 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 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-?
The CAS number of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- is 20426-62-4.
What is the molecular formula of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-?
The molecular formula of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- is C17H14BrNO3S.
What is the molecular weight of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-?
The molecular weight of 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- is 390.99 g/mol.
Where can I buy 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-?
You can request a quote for 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 5H-1-Benzazepin-5-one, 4-bromo-1,2-dihydro-1-(p-tolylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.