环己基硫代磷酰二氯胺
TL;DR: 环己基硫代磷酰二氯胺 (CAS 84439-65-6) is a chemical compound with molecular formula C6H12Cl2NPS and molecular weight 230.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环己基硫代磷酰二氯胺
N-dichlorophosphinothioylcyclohexanamine
Also Known As: Phosphoramidothioic dichloride, cyclohexyl-, N-dichlorophosphinothioylcyclohexanamine, N-Cyclohexylphosphoramidothioic dichloride, 4-(2-Piperidinoethoxy)benzoic acid hydrochloride
| Molecular Formula | C6H12Cl2NPS |
|---|---|
| Molecular Weight | 230.98 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.98051 |
| Heavy Atoms | 11 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 84439-65-6 |
|---|---|
| SMILES | C1CCC(CC1)NP(=S)(Cl)Cl |
| InChIKey | KKZFRWHDIIHVAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环己基硫代磷酰二氯胺 (CAS 84439-65-6), with molecular formula C6H12Cl2NPS and molecular weight 230.98 g/mol. IUPAC: N-dichlorophosphinothioylcyclohexanamine.
Chemical Property Profile of 环己基硫代磷酰二氯胺
Property Insights of 环己基硫代磷酰二氯胺
The XLogP value of 4.2 indicates that 环己基硫代磷酰二氯胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.1 Ų, 环己基硫代磷酰二氯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环己基硫代磷酰二氯胺 has 1 hydrogen bond donor(s) and 2 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 环己基硫代磷酰二氯胺?
The CAS number of 环己基硫代磷酰二氯胺 is 84439-65-6.
What is the molecular formula of 环己基硫代磷酰二氯胺?
The molecular formula of 环己基硫代磷酰二氯胺 is C6H12Cl2NPS.
What is the molecular weight of 环己基硫代磷酰二氯胺?
The molecular weight of 环己基硫代磷酰二氯胺 is 230.98 g/mol.
Where can I buy 环己基硫代磷酰二氯胺?
You can request a quote for 环己基硫代磷酰二氯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环己基硫代磷酰二氯胺?
Yes, KEHONG BIO provides custom synthesis services for 环己基硫代磷酰二氯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.