but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine
TL;DR: but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine (CAS 169675-09-6) is a chemical compound with molecular formula C15H16ClFN2O4 and molecular weight 342.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;(2S)-1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine
Also Known As: but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine, (2S)-1-(6-CHLORO-5-FLUOROINDOL-1-YL)PROPAN-2-AMINE; FUMARIC ACID, (AS)-6-CHLORO-5-FLUORO-ALPHA-METHYL-1H-INDOLE-1-ETHANAMINE FUMARATE
| Molecular Formula | C15H16ClFN2O4 |
|---|---|
| Molecular Weight | 342.08 g/mol |
| LogP | 2.4928 |
| Topological Polar Surface Area | 105.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.07828 |
| Heavy Atoms | 23 |
| Complexity | 724.3973 |
Chemical Identifiers
| CAS Number | 169675-09-6 |
|---|---|
| SMILES | C[C@@H](CN1C=CC2=CC(=C(C=C21)Cl)F)N.C(=CC(=O)O)C(=O)O |
Product Overview
but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine (CAS 169675-09-6), with molecular formula C15H16ClFN2O4 and molecular weight 342.08 g/mol. IUPAC: but-2-enedioic acid;(2S)-1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine.
Chemical Property Profile of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine
Property Insights of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine
The XLogP value of 2.4928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine. The TPSA of 105.55 Ų falls within the moderate polarity range, balancing permeability and solubility for but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine. Following Lipinski's Rule of Five, but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine has 3 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 but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine?
The CAS number of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine is 169675-09-6.
What is the molecular formula of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine?
The molecular formula of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine is C15H16ClFN2O4.
What is the molecular weight of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine?
The molecular weight of but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine is 342.08 g/mol.
Where can I buy but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine?
You can request a quote for but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-indol-1-yl)propan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.