AI 3-29107
TL;DR: AI 3-29107 (CAS 22941-84-0) is a chemical compound with molecular formula C14H20NO5PS and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] acetate
Also Known As: Staufffer R 15201, AI3-29107, AI 3-29107, O-(4-(1-((Acetyloxy)imino)ethyl)phenyl) O,O-diethyl phosphorothioate, Phosphorothioic acid, O,O-diethyl ester, O-ester with 4'-hydroxyacetophenone O-aceyloxime
| Molecular Formula | C14H20NO5PS |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 3.65 |
| Topological Polar Surface Area | 66.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 345.08 |
| Heavy Atoms | 22 |
| Complexity | 563.1008 |
Chemical Identifiers
| CAS Number | 22941-84-0 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=CC=C(C=C1)/C(=N/OC(=O)C)/C |
Product Overview
AI 3-29107 (CAS 22941-84-0), with molecular formula C14H20NO5PS and molecular weight 345.08 g/mol. IUPAC: [(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] acetate.
Chemical Property Profile of AI 3-29107
Property Insights of AI 3-29107
The XLogP value of 3.65 indicates that AI 3-29107 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.35 Ų falls within the moderate polarity range, balancing permeability and solubility for AI 3-29107. Following Lipinski's Rule of Five, AI 3-29107 has 0 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 AI 3-29107?
The CAS number of AI 3-29107 is 22941-84-0.
What is the molecular formula of AI 3-29107?
The molecular formula of AI 3-29107 is C14H20NO5PS.
What is the molecular weight of AI 3-29107?
The molecular weight of AI 3-29107 is 345.08 g/mol.
Where can I buy AI 3-29107?
You can request a quote for AI 3-29107 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AI 3-29107?
Yes, KEHONG BIO provides custom synthesis services for AI 3-29107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.