Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-
TL;DR: Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- (CAS 30544-71-9) is a chemical compound with molecular formula C19H20ClNO3 and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(N-(2-chlorobenzoyl)-2,6-dimethylanilino)butanoic acid
Also Known As: 4-(o-Chloro-N-2,6-xylylbenzamido)butyric acid, BUTYRIC ACID, 4-(o-CHLORO-N-2,6-XYLYLBENZAMIDO)-, N-(o-Chlorbenzoyl)-gamma-(2,6-dimethylanilino)-buttersaeure, N-(o-Chlorbenzoyl)-gamma-(2,6-dimethylanilino)-buttersaeure [German], 4-[o-Chlorobenzoyl(2,6-xylyl)amino]butyric acid
| Molecular Formula | C19H20ClNO3 |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.11316 |
| Heavy Atoms | 24 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 30544-71-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N(CCCC(=O)O)C(=O)C2=CC=CC=C2Cl |
| InChIKey | QTSWHDYFLYGYLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- (CAS 30544-71-9), with molecular formula C19H20ClNO3 and molecular weight 345.11 g/mol. IUPAC: 4-(N-(2-chlorobenzoyl)-2,6-dimethylanilino)butanoic acid.
Chemical Property Profile of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-
Property Insights of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-
The XLogP value of 4.2 indicates that Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- has 1 hydrogen bond donor(s) and 3 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 Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-?
The CAS number of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- is 30544-71-9.
What is the molecular formula of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-?
The molecular formula of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- is C19H20ClNO3.
What is the molecular weight of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-?
The molecular weight of Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- is 345.11 g/mol.
Where can I buy Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-?
You can request a quote for Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 4-(o-chloro-N-2,6-xylylbenzamido)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.