2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate
TL;DR: 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate (CAS 301313-77-9) is a chemical compound with molecular formula C21H23Cl2NO5S and molecular weight 471.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[butanoyl-(4-methylphenyl)sulfonylamino]-2,6-dichlorophenyl] butanoate
Also Known As: BAS 00350635, 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate, F0433-0117, 2,6-DICHLORO-4-[N-(4-METHYLBENZENESULFONYL)BUTANAMIDO]PHENYL BUTANOATE, [4-[butanoyl-(4-methylphenyl)sulfonylamino]-2,6-dichlorophenyl] butanoate
| Molecular Formula | C21H23Cl2NO5S |
|---|---|
| Molecular Weight | 471.07 g/mol |
| LogP | 5.52932 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.0674 |
| Heavy Atoms | 30 |
| Complexity | 1012.8574 |
Chemical Identifiers
| CAS Number | 301313-77-9 |
|---|---|
| SMILES | CCCC(=O)N(C1=CC(=C(C(=C1)Cl)OC(=O)CCC)Cl)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate (CAS 301313-77-9), with molecular formula C21H23Cl2NO5S and molecular weight 471.07 g/mol. IUPAC: [4-[butanoyl-(4-methylphenyl)sulfonylamino]-2,6-dichlorophenyl] butanoate.
Chemical Property Profile of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate
Property Insights of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate
The XLogP value of 5.52932 indicates that 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate. Following Lipinski's Rule of Five, 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate?
The CAS number of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate is 301313-77-9.
What is the molecular formula of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate?
The molecular formula of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate is C21H23Cl2NO5S.
What is the molecular weight of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate?
The molecular weight of 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate is 471.07 g/mol.
Where can I buy 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate?
You can request a quote for 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-dichloro-4-(N-tosylbutyramido)phenyl butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.