![3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid structure](/static/products/3073/307352-81-4.webp)
3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid
TL;DR: 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid (CAS 307352-81-4) is a chemical compound with molecular formula C18H13F2NO2 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic acid
Also Known As: 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid, 3-[1-(3,5-difluorobenzyl)-1H-indol-3-yl]acrylic acid, 3-(1-(3,5-Difluorobenzyl)-1H-indol-3-yl)acrylic acid, 3-[1-(3,5-DIFLUOROBENZYL)-1H-INDOL-3-YL]ACRYLICACID, (2E)-3-{1-[(3,5-difluorophenyl)methyl]-1H-indol-3-yl}prop-2-enoic acid
| Molecular Formula | C18H13F2NO2 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 4.0656 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.09143 |
| Heavy Atoms | 23 |
| Complexity | 892.27563 |
Chemical Identifiers
| CAS Number | 307352-81-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC(=C3)F)F)C=CC(=O)O |
Product Overview
3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid (CAS 307352-81-4), with molecular formula C18H13F2NO2 and molecular weight 313.09 g/mol. IUPAC: 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic acid.
Chemical Property Profile of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid
Property Insights of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid
The XLogP value of 4.0656 indicates that 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.23 Ų, 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid has 1 hydrogen bond donor(s) and 1 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-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid?
The CAS number of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid is 307352-81-4.
What is the molecular formula of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid?
The molecular formula of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid is C18H13F2NO2.
What is the molecular weight of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid?
The molecular weight of 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid is 313.09 g/mol.
Where can I buy 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid?
You can request a quote for 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-[(3,5-difluorophenyl)methyl]indol-3-yl]prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.