O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate
TL;DR: O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate (CAS 3678-18-0) is a chemical compound with molecular formula C9H19N2OPS and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methylaziridin-1-yl)-propoxy-sulfanylidene-λ5-phosphane
Also Known As: O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate, bis(2-methylaziridin-1-yl)-propoxy-sulfanylidene-, O-Propyl bis(2-methylaziridin-1-yl)phosphinothioate, 2-Butanone,3-methyl-4-(4-(1-methylethyl)cyclohexyl), bis(2-methylaziridin-1-yl)-propoxy-sulfanylidene-
| Molecular Formula | C9H19N2OPS |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.09557 |
| Heavy Atoms | 14 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 3678-18-0 |
|---|---|
| SMILES | CCCOP(=S)(N1CC1C)N2CC2C |
| InChIKey | BWAKWQXGWQEEEQ-UHFFFAOYSA-N |
Product Overview
O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate (CAS 3678-18-0), with molecular formula C9H19N2OPS and molecular weight 234.10 g/mol. IUPAC: bis(2-methylaziridin-1-yl)-propoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate
Property Insights of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate. With a topological polar surface area (TPSA) of 47.3 Ų, O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate has 0 hydrogen bond donor(s) and 4 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 O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate?
The CAS number of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate is 3678-18-0.
What is the molecular formula of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate?
The molecular formula of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate is C9H19N2OPS.
What is the molecular weight of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate?
The molecular weight of O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate is 234.10 g/mol.
Where can I buy O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate?
You can request a quote for O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate?
Yes, KEHONG BIO provides custom synthesis services for O-Propyl bis[(2-methylaziridin-1-yl)]phosphinothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.