1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)
TL;DR: 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) (CAS 148485-16-9) is a chemical compound with molecular formula C12H24N3PS and molecular weight 273.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(2,2-dimethylaziridin-1-yl)-sulfanylidene-λ5-phosphane
Also Known As: Thio-TEPA 132, KST-1B0554, 1,1',1''-phosphorothioyltris(2,2-dimethylaziridine), Phosphine sulfide,2-dimethyl-1-aziridinyl)-, tris(2,2-dimethylaziridin-1-yl)-sulfanylidene-
| Molecular Formula | C12H24N3PS |
|---|---|
| Molecular Weight | 273.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.14285 |
| Heavy Atoms | 17 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 148485-16-9 |
|---|---|
| SMILES | CC1(CN1P(=S)(N2CC2(C)C)N3CC3(C)C)C |
| InChIKey | UFRNRTFRYJYVKR-UHFFFAOYSA-N |
Product Overview
1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) (CAS 148485-16-9), with molecular formula C12H24N3PS and molecular weight 273.14 g/mol. IUPAC: tris(2,2-dimethylaziridin-1-yl)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)
Property Insights of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)
The XLogP value of 3.0 indicates that 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) 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 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)?
The CAS number of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) is 148485-16-9.
What is the molecular formula of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)?
The molecular formula of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) is C12H24N3PS.
What is the molecular weight of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)?
The molecular weight of 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) is 273.14 g/mol.
Where can I buy 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)?
You can request a quote for 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine)?
Yes, KEHONG BIO provides custom synthesis services for 1,1',1''-Phosphorothioyltris(2,2-dimethylaziridine) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.