![Alanine,N-[(2-nitrophenyl)thio] structure](/static/products/5879/5879-51-6.webp)
Alanine,N-[(2-nitrophenyl)thio]
TL;DR: Alanine,N-[(2-nitrophenyl)thio] (CAS 5879-51-6) is a chemical compound with molecular formula C26H31NO5S and molecular weight 469.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-cyclopentylpropanoyl)-2-(4-methoxy-3-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
Also Known As: Alanine,N-[(2-nitrophenyl)thio], 2-[3-(Benzyloxy)-4-methoxyphenyl]-3-(3-cyclopentylpropanoyl)-1,3-thiazolidine-4-carboxylic acid, 3-(3-cyclopentylpropanoyl)-2-(4-methoxy-3-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid, 3-(3-cyclopentylpropanoyl)-2-(4-methoxy-3-phenylmethoxy-phenyl)-1,3-thiazolidine-4-carboxylic Acid
| Molecular Formula | C26H31NO5S |
|---|---|
| Molecular Weight | 469.19 g/mol |
| LogP | 5.2718 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 469.1923 |
| Heavy Atoms | 33 |
| Complexity | 960.40955 |
Chemical Identifiers
| CAS Number | 5879-51-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)CCC3CCCC3)OCC4=CC=CC=C4 |
Product Overview
Alanine,N-[(2-nitrophenyl)thio] (CAS 5879-51-6), with molecular formula C26H31NO5S and molecular weight 469.19 g/mol. IUPAC: 3-(3-cyclopentylpropanoyl)-2-(4-methoxy-3-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of Alanine,N-[(2-nitrophenyl)thio]
Property Insights of Alanine,N-[(2-nitrophenyl)thio]
The XLogP value of 5.2718 indicates that Alanine,N-[(2-nitrophenyl)thio] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine,N-[(2-nitrophenyl)thio]. Following Lipinski's Rule of Five, Alanine,N-[(2-nitrophenyl)thio] has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alanine,N-[(2-nitrophenyl)thio]?
The CAS number of Alanine,N-[(2-nitrophenyl)thio] is 5879-51-6.
What is the molecular formula of Alanine,N-[(2-nitrophenyl)thio]?
The molecular formula of Alanine,N-[(2-nitrophenyl)thio] is C26H31NO5S.
What is the molecular weight of Alanine,N-[(2-nitrophenyl)thio]?
The molecular weight of Alanine,N-[(2-nitrophenyl)thio] is 469.19 g/mol.
Where can I buy Alanine,N-[(2-nitrophenyl)thio]?
You can request a quote for Alanine,N-[(2-nitrophenyl)thio] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine,N-[(2-nitrophenyl)thio]?
Yes, KEHONG BIO provides custom synthesis services for Alanine,N-[(2-nitrophenyl)thio] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.