RefChem:371510
TL;DR: RefChem:371510 (CAS 4814-47-5) is a chemical compound with molecular formula C10H22NO5PS3 and molecular weight 363.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bis(methylsulfanyl)phosphorylsulfanyl-N,N-diethylethanamine;oxalic acid
Also Known As: Phosphorotrithioic acid, S-(2-(diethylamino)ethyl) S,S-dimethyl ester, oxalate (1:1), 2-bis(methylsulfanyl)phosphorylsulfanyl-N,N-diethylethanamine; oxalic acid, Oxalic acid--S-[2-(diethylamino)ethyl] S,S-dimethyl phosphorotrithioate (1/1), RefChem:371510
| Molecular Formula | C10H22NO5PS3 |
|---|---|
| Molecular Weight | 363.04 g/mol |
| LogP | 3.0511 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 363.03976 |
| Heavy Atoms | 20 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 4814-47-5 |
|---|---|
| SMILES | CCN(CC)CCSP(=O)(SC)SC.C(=O)(C(=O)O)O |
| InChIKey | LHZKPSBCQYNODX-UHFFFAOYSA-N |
Product Overview
RefChem:371510 (CAS 4814-47-5), with molecular formula C10H22NO5PS3 and molecular weight 363.04 g/mol. IUPAC: 2-bis(methylsulfanyl)phosphorylsulfanyl-N,N-diethylethanamine;oxalic acid.
Chemical Property Profile of RefChem:371510
Property Insights of RefChem:371510
The XLogP value of 3.0511 indicates that RefChem:371510 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 171.0 Ų indicates high polarity, suggesting RefChem:371510 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:371510 has 2 hydrogen bond donor(s) and 9 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 RefChem:371510?
The CAS number of RefChem:371510 is 4814-47-5.
What is the molecular formula of RefChem:371510?
The molecular formula of RefChem:371510 is C10H22NO5PS3.
What is the molecular weight of RefChem:371510?
The molecular weight of RefChem:371510 is 363.04 g/mol.
Where can I buy RefChem:371510?
You can request a quote for RefChem:371510 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371510?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371510 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.