![3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide structure](/static/products/861/861209-79-2.png)
3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide
TL;DR: 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide (CAS 861209-79-2) is a chemical compound with molecular formula C19H17Cl2NO and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-(3-hex-1-ynylphenyl)benzamide
Also Known As: 3,4-dichloro-N-(3-hex-1-ynylphenyl)benzamide, 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide, 3,4-dichloro-N-[3-(hex-1-yn-1-yl)phenyl]benzamide, 2T-1137
| Molecular Formula | C19H17Cl2NO |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 5.7874 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.06873 |
| Heavy Atoms | 23 |
| Complexity | 759.4503 |
Chemical Identifiers
| CAS Number | 861209-79-2 |
|---|---|
| SMILES | CCCCC#CC1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide (CAS 861209-79-2), with molecular formula C19H17Cl2NO and molecular weight 345.07 g/mol. IUPAC: 3,4-dichloro-N-(3-hex-1-ynylphenyl)benzamide.
Chemical Property Profile of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide
Property Insights of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide
The XLogP value of 5.7874 indicates that 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide?
The CAS number of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide is 861209-79-2.
What is the molecular formula of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide?
The molecular formula of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide is C19H17Cl2NO.
What is the molecular weight of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide?
The molecular weight of 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide is 345.07 g/mol.
Where can I buy 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide?
You can request a quote for 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-[3-(1-hexynyl)phenyl]benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.