N-Hexamethylene N',N''-diethylene thiophosphoramide
TL;DR: N-Hexamethylene N',N''-diethylene thiophosphoramide (CAS 152-01-2) is a chemical compound with molecular formula C10H20N3PS and molecular weight 245.11156 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azepan-1-yl-bis(aziridin-1-yl)-sulfanylidene-λ5-phosphane
Also Known As: NCIOpen2_002859, N-Hexamethylene N',N''-diethylene thiophosphoramide, KC 33, KST-1B0673, 1-[bis(aziridin-1-yl)phosphorothioyl]azepane
Technical Specifications
| Molecular Formula | C10H20N3PS |
| Molecular Weight | 245.11156 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 41.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.11156 Da |
| Heavy Atoms | 15 |
| Complexity | 264.0 |
| SMILES | C1CCCN(CC1)P(=S)(N2CC2)N3CC3 |
| InChIKey | IAQOECAZMQEZLI-UHFFFAOYSA-N |
Product Description
Applications: N-Hexamethylene N',N''-diethylene thiophosphoramide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
N-Hexamethylene N',N''-diethylene thiophosphoramide (CAS 152-01-2) is a fine chemical with the molecular formula C10H20N3PS and a molecular weight of 245.11 g/mol. Synonyms include KC-33 and NCIOpen2_002859.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-Hexamethylene N',N''-diethylene thiophosphoramide
Property Insights of N-Hexamethylene N',N''-diethylene thiophosphoramide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Hexamethylene N',N''-diethylene thiophosphoramide. With a topological polar surface area (TPSA) of 41.4 Ų, N-Hexamethylene N',N''-diethylene thiophosphoramide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Hexamethylene N',N''-diethylene thiophosphoramide 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
What is the CAS number of N-Hexamethylene N',N''-diethylene thiophosphoramide?
The CAS number of N-Hexamethylene N',N''-diethylene thiophosphoramide is 152-01-2.
What is the molecular formula of N-Hexamethylene N',N''-diethylene thiophosphoramide?
The molecular formula of N-Hexamethylene N',N''-diethylene thiophosphoramide is C10H20N3PS.
What is the molecular weight of N-Hexamethylene N',N''-diethylene thiophosphoramide?
The molecular weight of N-Hexamethylene N',N''-diethylene thiophosphoramide is 245.11156 g/mol.
What are the applications of N-Hexamethylene N',N''-diethylene thiophosphoramide?
N-Hexamethylene N',N''-diethylene thiophosphoramide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy N-Hexamethylene N',N''-diethylene thiophosphoramide?
You can request a quote for N-Hexamethylene N',N''-diethylene thiophosphoramide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Hexamethylene N',N''-diethylene thiophosphoramide?
Yes, CoreyChem provides custom synthesis services for N-Hexamethylene N',N''-diethylene thiophosphoramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.