6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one
TL;DR: 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one (CAS 197915-35-8) is a chemical compound with molecular formula C28H21NO3S and molecular weight 451.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-6-benzylidene-5-(4-methylphenyl)sulfonylbenzo[d][1]benzazepin-7-one
Also Known As: 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one, (6E)-6-benzylidene-5-(p-tolylsulfonyl)benzo[d][1]benzazepin-7-one, (6E)-6-benzylidene-5-(4-methylphenyl)sulfonylbenzo[d][1]benzazepin-7-one, 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo[b,d]azepin-7-one, 6-benzylidene-5-[(4-methylphenyl)sulfonyl]-5,6-dihydro-7h-dibenzo[b,d]azepin-7-one
| Molecular Formula | C28H21NO3S |
|---|---|
| Molecular Weight | 451.12 g/mol |
| LogP | 6.09472 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 451.1242 |
| Heavy Atoms | 33 |
| Complexity | 1487.9309 |
Chemical Identifiers
| CAS Number | 197915-35-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N\2C3=CC=CC=C3C4=CC=CC=C4C(=O)/C2=C\C5=CC=CC=C5 |
Product Overview
6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one (CAS 197915-35-8), with molecular formula C28H21NO3S and molecular weight 451.12 g/mol. IUPAC: (6E)-6-benzylidene-5-(4-methylphenyl)sulfonylbenzo[d][1]benzazepin-7-one.
Chemical Property Profile of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one
Property Insights of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one
The XLogP value of 6.09472 indicates that 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one?
The CAS number of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one is 197915-35-8.
What is the molecular formula of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one?
The molecular formula of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one is C28H21NO3S.
What is the molecular weight of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one?
The molecular weight of 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one is 451.12 g/mol.
Where can I buy 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one?
You can request a quote for 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzylidene-5-((4-methylphenyl)sulfonyl)-5,6-dihydro-7H-dibenzo(b,d)azepin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.