Fmoc-L-3-Benzothienylalanine
TL;DR: Fmoc-L-3-Benzothienylalanine (CAS 177966-61-9) is a chemical compound with molecular formula C26H21NO4S and molecular weight 443.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Also Known As: Fmoc-L-3-Benzothienylalanine, Fmoc-3-Ala(3-benzothienyl)-OH, Fmoc-Bta-OH, Fmoc-L-3-Benzothienylala, Fmoc-3-(3-benzothienyl)-L-alanine
| Molecular Formula | C26H21NO4S |
|---|---|
| Molecular Weight | 443.12 g/mol |
| LogP | 5.4357 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.11914 |
| Heavy Atoms | 32 |
| Complexity | 1266.4431 |
Chemical Identifiers
| CAS Number | 177966-61-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CSC5=CC=CC=C54)C(=O)O |
Product Overview
Fmoc-L-3-Benzothienylalanine (CAS 177966-61-9), with molecular formula C26H21NO4S and molecular weight 443.12 g/mol. IUPAC: (2S)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid.
Chemical Property Profile of Fmoc-L-3-Benzothienylalanine
Property Insights of Fmoc-L-3-Benzothienylalanine
The XLogP value of 5.4357 indicates that Fmoc-L-3-Benzothienylalanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Fmoc-L-3-Benzothienylalanine. Following Lipinski's Rule of Five, Fmoc-L-3-Benzothienylalanine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fmoc-L-3-Benzothienylalanine?
The CAS number of Fmoc-L-3-Benzothienylalanine is 177966-61-9.
What is the molecular formula of Fmoc-L-3-Benzothienylalanine?
The molecular formula of Fmoc-L-3-Benzothienylalanine is C26H21NO4S.
What is the molecular weight of Fmoc-L-3-Benzothienylalanine?
The molecular weight of Fmoc-L-3-Benzothienylalanine is 443.12 g/mol.
Where can I buy Fmoc-L-3-Benzothienylalanine?
You can request a quote for Fmoc-L-3-Benzothienylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fmoc-L-3-Benzothienylalanine?
Yes, KEHONG BIO provides custom synthesis services for Fmoc-L-3-Benzothienylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.