C28H26ClNO6S
TL;DR: C28H26ClNO6S (CAS 1008243-55-7) is a chemical compound with molecular formula C28H26ClNO6S and molecular weight 539.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate
Also Known As: (3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate
| Molecular Formula | C28H26ClNO6S |
|---|---|
| Molecular Weight | 539.12 g/mol |
| LogP | 5.31654 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 539.11694 |
| Heavy Atoms | 37 |
| Complexity | 1613.0592 |
Chemical Identifiers
| CAS Number | 1008243-55-7 |
|---|---|
| SMILES | CC[C@H](C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NS(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
C28H26ClNO6S (CAS 1008243-55-7), with molecular formula C28H26ClNO6S and molecular weight 539.12 g/mol. IUPAC: (3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate.
Chemical Property Profile of C28H26ClNO6S
Property Insights of C28H26ClNO6S
The XLogP value of 5.31654 indicates that C28H26ClNO6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.68 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H26ClNO6S. Following Lipinski's Rule of Five, C28H26ClNO6S has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C28H26ClNO6S?
The CAS number of C28H26ClNO6S is 1008243-55-7.
What is the molecular formula of C28H26ClNO6S?
The molecular formula of C28H26ClNO6S is C28H26ClNO6S.
What is the molecular weight of C28H26ClNO6S?
The molecular weight of C28H26ClNO6S is 539.12 g/mol.
Where can I buy C28H26ClNO6S?
You can request a quote for C28H26ClNO6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C28H26ClNO6S?
Yes, KEHONG BIO provides custom synthesis services for C28H26ClNO6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.