N,N',N''-Trioctylphosphorothioic triamide
TL;DR: N,N',N''-Trioctylphosphorothioic triamide (CAS 59288-81-2) is a chemical compound with molecular formula C24H54N3PS and molecular weight 447.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-bis(octylamino)phosphinothioyloctan-1-amine
Also Known As: N,N',N''-TRIOCTYLPHOSPHOROTHIOIC TRIAMIDE, N-bis(octylamino)phosphinothioyloctan-1-amine, N,N''-TRIOCTYLPHOSPHOROTHIOIC TRIAMIDE
| Molecular Formula | C24H54N3PS |
|---|---|
| Molecular Weight | 447.38 g/mol |
| LogP | 10.7 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 24 |
| Exact Mass | 447.3776 |
| Heavy Atoms | 29 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 59288-81-2 |
|---|---|
| SMILES | CCCCCCCCNP(=S)(NCCCCCCCC)NCCCCCCCC |
| InChIKey | ZWLLRQOLZSCTQQ-UHFFFAOYSA-N |
Product Overview
N,N',N''-Trioctylphosphorothioic triamide (CAS 59288-81-2), with molecular formula C24H54N3PS and molecular weight 447.38 g/mol. IUPAC: N-bis(octylamino)phosphinothioyloctan-1-amine.
Chemical Property Profile of N,N',N''-Trioctylphosphorothioic triamide
Property Insights of N,N',N''-Trioctylphosphorothioic triamide
The XLogP value of 10.7 indicates that N,N',N''-Trioctylphosphorothioic triamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N',N''-Trioctylphosphorothioic triamide. Following Lipinski's Rule of Five, N,N',N''-Trioctylphosphorothioic triamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N',N''-Trioctylphosphorothioic triamide?
The CAS number of N,N',N''-Trioctylphosphorothioic triamide is 59288-81-2.
What is the molecular formula of N,N',N''-Trioctylphosphorothioic triamide?
The molecular formula of N,N',N''-Trioctylphosphorothioic triamide is C24H54N3PS.
What is the molecular weight of N,N',N''-Trioctylphosphorothioic triamide?
The molecular weight of N,N',N''-Trioctylphosphorothioic triamide is 447.38 g/mol.
Where can I buy N,N',N''-Trioctylphosphorothioic triamide?
You can request a quote for N,N',N''-Trioctylphosphorothioic triamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N',N''-Trioctylphosphorothioic triamide?
Yes, KEHONG BIO provides custom synthesis services for N,N',N''-Trioctylphosphorothioic triamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.