RefChem:1095488
TL;DR: RefChem:1095488 (CAS 22936-01-2) is a chemical compound with molecular formula C13H19N2O5PS and molecular weight 346.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(4-dimethoxyphosphinothioyloxyphenyl)methylideneamino] N-propan-2-ylcarbamate
Also Known As: 4-(O-(O,O-Diethylphosphorothioyl))benzaldoximino-N-isopropylcarbamate, Phosphorothioic acid, O,O-dimethyl O-(4-((((((1-methylethyl)amino)carbonyl)oxy)imino)methyl)phenyl) ester, RefChem:1095488
| Molecular Formula | C13H19N2O5PS |
|---|---|
| Molecular Weight | 346.08 g/mol |
| LogP | 3.0512 |
| Topological Polar Surface Area | 78.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 346.07523 |
| Heavy Atoms | 22 |
| Complexity | 554.05383 |
Chemical Identifiers
| CAS Number | 22936-01-2 |
|---|---|
| SMILES | CC(C)NC(=O)O/N=C/C1=CC=C(C=C1)OP(=S)(OC)OC |
Product Overview
RefChem:1095488 (CAS 22936-01-2), with molecular formula C13H19N2O5PS and molecular weight 346.08 g/mol. IUPAC: [(E)-(4-dimethoxyphosphinothioyloxyphenyl)methylideneamino] N-propan-2-ylcarbamate.
Chemical Property Profile of RefChem:1095488
Property Insights of RefChem:1095488
The XLogP value of 3.0512 indicates that RefChem:1095488 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.38 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1095488. Following Lipinski's Rule of Five, RefChem:1095488 has 1 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 RefChem:1095488?
The CAS number of RefChem:1095488 is 22936-01-2.
What is the molecular formula of RefChem:1095488?
The molecular formula of RefChem:1095488 is C13H19N2O5PS.
What is the molecular weight of RefChem:1095488?
The molecular weight of RefChem:1095488 is 346.08 g/mol.
Where can I buy RefChem:1095488?
You can request a quote for RefChem:1095488 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095488?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095488 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.