Alanine, ethyl ester, hydrochloride, L-
TL;DR: Alanine, ethyl ester, hydrochloride, L- (CAS 27486-86-8) is a chemical compound with molecular formula C24H25NO2S and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-3-tritylsulfanylpropanoate
Also Known As: Ethyl S-(triphenylmethyl)cysteinate, Alanine, ethyl ester, hydrochloride, L-, ethyl 2-amino-3-tritylsulfanylpropanoate
| Molecular Formula | C24H25NO2S |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 391.1606 |
| Heavy Atoms | 28 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 27486-86-8 |
|---|---|
| SMILES | CCOC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N |
| InChIKey | YTVDRQFRVFLYAT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alanine, ethyl ester, hydrochloride, L- (CAS 27486-86-8), with molecular formula C24H25NO2S and molecular weight 391.16 g/mol. IUPAC: ethyl 2-amino-3-tritylsulfanylpropanoate.
Chemical Property Profile of Alanine, ethyl ester, hydrochloride, L-
Property Insights of Alanine, ethyl ester, hydrochloride, L-
The XLogP value of 4.9 indicates that Alanine, ethyl ester, hydrochloride, L- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, ethyl ester, hydrochloride, L-. Following Lipinski's Rule of Five, Alanine, ethyl ester, hydrochloride, L- has 1 hydrogen bond donor(s) and 4 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 Alanine, ethyl ester, hydrochloride, L-?
The CAS number of Alanine, ethyl ester, hydrochloride, L- is 27486-86-8.
What is the molecular formula of Alanine, ethyl ester, hydrochloride, L-?
The molecular formula of Alanine, ethyl ester, hydrochloride, L- is C24H25NO2S.
What is the molecular weight of Alanine, ethyl ester, hydrochloride, L-?
The molecular weight of Alanine, ethyl ester, hydrochloride, L- is 391.16 g/mol.
Where can I buy Alanine, ethyl ester, hydrochloride, L-?
You can request a quote for Alanine, ethyl ester, hydrochloride, L- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, ethyl ester, hydrochloride, L-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, ethyl ester, hydrochloride, L- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.