AI 3-27239
TL;DR: AI 3-27239 (CAS 17702-63-5) is a chemical compound with molecular formula C6H15N2O3PS2 and molecular weight 258.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-dimethoxyphosphinothioyl-1-(2-hydroxyethyl)-1-methylthiourea
Also Known As: Stauffer B-10288, ENT 27,239, AI3-27239, AI 3-27239, B 10288
| Molecular Formula | C6H15N2O3PS2 |
|---|---|
| Molecular Weight | 258.03 g/mol |
| LogP | 0.3023 |
| Topological Polar Surface Area | 53.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.02618 |
| Heavy Atoms | 14 |
| Complexity | 231.1165 |
Chemical Identifiers
| CAS Number | 17702-63-5 |
|---|---|
| SMILES | CN(CCO)C(=S)NP(=S)(OC)OC |
Product Overview
AI 3-27239 (CAS 17702-63-5), with molecular formula C6H15N2O3PS2 and molecular weight 258.03 g/mol. IUPAC: 3-dimethoxyphosphinothioyl-1-(2-hydroxyethyl)-1-methylthiourea.
Chemical Property Profile of AI 3-27239
Property Insights of AI 3-27239
The XLogP value of 0.3023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AI 3-27239. With a topological polar surface area (TPSA) of 53.96 Ų, AI 3-27239 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AI 3-27239 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 AI 3-27239?
The CAS number of AI 3-27239 is 17702-63-5.
What is the molecular formula of AI 3-27239?
The molecular formula of AI 3-27239 is C6H15N2O3PS2.
What is the molecular weight of AI 3-27239?
The molecular weight of AI 3-27239 is 258.03 g/mol.
Where can I buy AI 3-27239?
You can request a quote for AI 3-27239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AI 3-27239?
Yes, KEHONG BIO provides custom synthesis services for AI 3-27239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.