![[(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid structure](/static/products/4382/438230-86-5.webp)
[(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid
TL;DR: [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid (CAS 438230-86-5) is a chemical compound with molecular formula C12H14N2O6S2 and molecular weight 346.03 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-oxoethyl]sulfanylacetic acid
Also Known As: [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid, {[2-({3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethyl]sulfanyl}acetic acid, 2-((2-((3-((2-hydroxyethyl)thio)-5-nitrophenyl)amino)-2-oxoethyl)thio)acetic acid, 2-[[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]carbamoylmethylsulfanyl]acetic Acid, 2-[2-[3-(2-hydroxyethylsulfanyl)-5-nitroanilino]-2-oxoethyl]sulfanylacetic acid
| Molecular Formula | C12H14N2O6S2 |
|---|---|
| Molecular Weight | 346.03 g/mol |
| LogP | 1.4355 |
| Topological Polar Surface Area | 129.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 346.02933 |
| Heavy Atoms | 22 |
| Complexity | 566.5475 |
Chemical Identifiers
| CAS Number | 438230-86-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])SCCO)NC(=O)CSCC(=O)O |
Product Overview
[(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid (CAS 438230-86-5), with molecular formula C12H14N2O6S2 and molecular weight 346.03 g/mol. IUPAC: 2-[2-[3-(2-hydroxyethylsulfanyl)-5-nitroanilino]-2-oxoethyl]sulfanylacetic acid.
Chemical Property Profile of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid
Property Insights of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid
The XLogP value of 1.4355 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid. The TPSA of 129.77 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid. Following Lipinski's Rule of Five, [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]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-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid?
The CAS number of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid is 438230-86-5.
What is the molecular formula of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid?
The molecular formula of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid is C12H14N2O6S2.
What is the molecular weight of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid?
The molecular weight of [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid is 346.03 g/mol.
Where can I buy [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid?
You can request a quote for [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]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-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(2-{3-[(2-hydroxyethyl)sulfanyl]-5-nitroanilino}-2-oxoethyl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.