(2-(4-乙酰氨基苯基)苯基)硫酸氢酯
TL;DR: (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 (CAS 118608-93-8) is a chemical compound with molecular formula C14H13NO5S and molecular weight 307.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-(4-乙酰氨基苯基)苯基)硫酸氢酯
[2-(4-acetamidophenyl)phenyl] hydrogen sulfate
Also Known As: (2-(4-Acetamidophenyl)phenyl) hydrogen sulfate, 4'-(acetylamino)biphenyl-2-yl hydrogen sulfate, 1-acetamido-4-(2-sulfooxyphenyl)benzene, [2-(4-acetamidophenyl)phenyl] hydrogen sulfate, Acetamide,N-[2'-(sulfooxy)[1,1'-biphenyl]-4-yl]-
| Molecular Formula | C14H13NO5S |
|---|---|
| Molecular Weight | 307.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.05145 |
| Heavy Atoms | 21 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 118608-93-8 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=CC=CC=C2OS(=O)(=O)O |
| InChIKey | JONNKPJZTSYZJT-UHFFFAOYSA-N |
Product Overview
(2-(4-乙酰氨基苯基)苯基)硫酸氢酯 (CAS 118608-93-8), with molecular formula C14H13NO5S and molecular weight 307.05 g/mol. IUPAC: [2-(4-acetamidophenyl)phenyl] hydrogen sulfate.
Chemical Property Profile of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯
Property Insights of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-(4-乙酰氨基苯基)苯基)硫酸氢酯. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-(4-乙酰氨基苯基)苯基)硫酸氢酯. Following Lipinski's Rule of Five, (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 has 2 hydrogen bond donor(s) and 5 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-(4-乙酰氨基苯基)苯基)硫酸氢酯?
The CAS number of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 is 118608-93-8.
What is the molecular formula of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯?
The molecular formula of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 is C14H13NO5S.
What is the molecular weight of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯?
The molecular weight of (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 is 307.05 g/mol.
Where can I buy (2-(4-乙酰氨基苯基)苯基)硫酸氢酯?
You can request a quote for (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(4-乙酰氨基苯基)苯基)硫酸氢酯?
Yes, KEHONG BIO provides custom synthesis services for (2-(4-乙酰氨基苯基)苯基)硫酸氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.