2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde
TL;DR: 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde (CAS 590348-31-5) is a chemical compound with molecular formula C14H16FNO and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde
Also Known As: 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde, 2-(tert-Butyl)-4-fluoro-7-methyl-1H-indole-3-carbaldehyde, AB01333195-02
| Molecular Formula | C14H16FNO |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | 3.72542 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.1216 |
| Heavy Atoms | 17 |
| Complexity | 590.2685 |
Chemical Identifiers
| CAS Number | 590348-31-5 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)F)C(=C(N2)C(C)(C)C)C=O |
Product Overview
2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde (CAS 590348-31-5), with molecular formula C14H16FNO and molecular weight 233.12 g/mol. IUPAC: 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde.
Chemical Property Profile of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde
Property Insights of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde
The XLogP value of 3.72542 indicates that 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde 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 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde?
The CAS number of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde is 590348-31-5.
What is the molecular formula of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde?
The molecular formula of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde is C14H16FNO.
What is the molecular weight of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde?
The molecular weight of 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde is 233.12 g/mol.
Where can I buy 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde?
You can request a quote for 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-butyl-4-fluoro-7-methyl-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.