![[2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid structure](/static/products/4382/438230-22-9.webp)
[2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid
TL;DR: [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid (CAS 438230-22-9) is a chemical compound with molecular formula C12H14N2O7S and molecular weight 330.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[3-(2-hydroxyethylsulfanyl)-5-nitroanilino]-2-oxoethoxy]acetic acid
Also Known As: (2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethoxy)acetic acid, 2-[2-[3-(2-hydroxyethylsulfanyl)-5-nitroanilino]-2-oxoethoxy]acetic acid, [2-({3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid, 2-(2-((3-((2-hydroxyethyl)thio)-5-nitrophenyl)amino)-2-oxoethoxy)acetic acid, 2-(2-{3-[(2-HYDROXYETHYL)SULFANYL]-5-NITROANILINO}-2-OXOETHOXY)ACETIC ACID
| Molecular Formula | C12H14N2O7S |
|---|---|
| Molecular Weight | 330.05 g/mol |
| LogP | 0.7189 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 330.0522 |
| Heavy Atoms | 22 |
| Complexity | 564.4058 |
Chemical Identifiers
| CAS Number | 438230-22-9 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])SCCO)NC(=O)COCC(=O)O |
Product Overview
[2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid (CAS 438230-22-9), with molecular formula C12H14N2O7S and molecular weight 330.05 g/mol. IUPAC: 2-[2-[3-(2-hydroxyethylsulfanyl)-5-nitroanilino]-2-oxoethoxy]acetic acid.
Chemical Property Profile of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid
Property Insights of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid
The XLogP value of 0.7189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid. Following Lipinski's Rule of Five, [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid has 3 hydrogen bond donor(s) and 7 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-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid?
The CAS number of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid is 438230-22-9.
What is the molecular formula of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid?
The molecular formula of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid is C12H14N2O7S.
What is the molecular weight of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid?
The molecular weight of [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid is 330.05 g/mol.
Where can I buy [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid?
You can request a quote for [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [2-({3-[(2-Hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.