S-(2-羟乙基)硫代苯氨基甲酸酯
TL;DR: S-(2-羟乙基)硫代苯氨基甲酸酯 (CAS 5628-90-0) is a chemical compound with molecular formula C9H11NO2S and molecular weight 197.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-羟乙基)硫代苯氨基甲酸酯
S-(2-hydroxyethyl) N-phenylcarbamothioate
Also Known As: 2-Hydroxyethyl thiolcarbanilate, PhenylthiocarbamicacidS- ester, 5,6-Dimethylen-norborn-2-en, Thiocarbanilic acid S-(2-hydroxyethyl) ester, 2-[(phenylcarbamoyl)sulfanyl]ethan-1-ol
| Molecular Formula | C9H11NO2S |
|---|---|
| Molecular Weight | 197.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.05106 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 5628-90-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)SCCO |
| InChIKey | WYENFOLZWFFYQG-UHFFFAOYSA-N |
Product Overview
S-(2-羟乙基)硫代苯氨基甲酸酯 (CAS 5628-90-0), with molecular formula C9H11NO2S and molecular weight 197.05 g/mol. IUPAC: S-(2-hydroxyethyl) N-phenylcarbamothioate.
Chemical Property Profile of S-(2-羟乙基)硫代苯氨基甲酸酯
Property Insights of S-(2-羟乙基)硫代苯氨基甲酸酯
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-羟乙基)硫代苯氨基甲酸酯. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-羟乙基)硫代苯氨基甲酸酯. Following Lipinski's Rule of Five, S-(2-羟乙基)硫代苯氨基甲酸酯 has 2 hydrogen bond donor(s) and 3 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 S-(2-羟乙基)硫代苯氨基甲酸酯?
The CAS number of S-(2-羟乙基)硫代苯氨基甲酸酯 is 5628-90-0.
What is the molecular formula of S-(2-羟乙基)硫代苯氨基甲酸酯?
The molecular formula of S-(2-羟乙基)硫代苯氨基甲酸酯 is C9H11NO2S.
What is the molecular weight of S-(2-羟乙基)硫代苯氨基甲酸酯?
The molecular weight of S-(2-羟乙基)硫代苯氨基甲酸酯 is 197.05 g/mol.
Where can I buy S-(2-羟乙基)硫代苯氨基甲酸酯?
You can request a quote for S-(2-羟乙基)硫代苯氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-羟乙基)硫代苯氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for S-(2-羟乙基)硫代苯氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.