3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one
TL;DR: 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one (CAS 902506-97-2) is a chemical compound with molecular formula C19H16F2O4S and molecular weight 378.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one
Also Known As: VU0511486-1, 3-(4-tert-butylbenzenesulfonyl)-6,8-difluoro-2H-chromen-2-one, 3-(4-tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one, F3165-1481, 3-((4-(tert-butyl)phenyl)sulfonyl)-6,8-difluoro-2H-chromen-2-one
| Molecular Formula | C19H16F2O4S |
|---|---|
| Molecular Weight | 378.07 g/mol |
| LogP | 4.2015 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.07373 |
| Heavy Atoms | 26 |
| Complexity | 1155.0939 |
Chemical Identifiers
| CAS Number | 902506-97-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC3=CC(=CC(=C3OC2=O)F)F |
Product Overview
3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one (CAS 902506-97-2), with molecular formula C19H16F2O4S and molecular weight 378.07 g/mol. IUPAC: 3-(4-tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one.
Chemical Property Profile of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one
Property Insights of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one
The XLogP value of 4.2015 indicates that 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one. Following Lipinski's Rule of Five, 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one 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 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one?
The CAS number of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one is 902506-97-2.
What is the molecular formula of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one?
The molecular formula of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one is C19H16F2O4S.
What is the molecular weight of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one?
The molecular weight of 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one is 378.07 g/mol.
Where can I buy 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one?
You can request a quote for 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Tert-butylphenyl)sulfonyl-6,8-difluorochromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.