Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester
TL;DR: Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester (CAS 73972-84-6) is a chemical compound with molecular formula C11H17N2O4PS and molecular weight 304.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-dimethoxyphosphinothioyloxyphenyl)-1,1-dimethylurea
Also Known As: O-(o-(3,3-Dimethylureido)phenyl) O,O-dimethyl phosphorothionate, Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester, 3-(2-dimethoxyphosphinothioyloxyphenyl)-1,1-dimethylurea, O-2-[(dimethylcarbamoyl)amino]phenyl O,O-dimethyl phosphorothioate, O-{2-[(Dimethylcarbamoyl)amino]phenyl} O,O-dimethyl phosphorothioate
| Molecular Formula | C11H17N2O4PS |
|---|---|
| Molecular Weight | 304.06 g/mol |
| LogP | 2.6762 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.06467 |
| Heavy Atoms | 19 |
| Complexity | 487.33847 |
Chemical Identifiers
| CAS Number | 73972-84-6 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC=CC=C1OP(=S)(OC)OC |
Product Overview
Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester (CAS 73972-84-6), with molecular formula C11H17N2O4PS and molecular weight 304.06 g/mol. IUPAC: 3-(2-dimethoxyphosphinothioyloxyphenyl)-1,1-dimethylurea.
Chemical Property Profile of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester
Property Insights of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester
The XLogP value of 2.6762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester. Following Lipinski's Rule of Five, Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester has 1 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 Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester?
The CAS number of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester is 73972-84-6.
What is the molecular formula of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester?
The molecular formula of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester is C11H17N2O4PS.
What is the molecular weight of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester?
The molecular weight of Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester is 304.06 g/mol.
Where can I buy Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester?
You can request a quote for Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O,O-dimethyl O-(o-(3,3-dimethylureido)phenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.