RefChem:339811
TL;DR: RefChem:339811 (CAS 74277-03-5) is a chemical compound with molecular formula C12H22Cl2N2S2 and molecular weight 328.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethyl-diethylazanium chloride
Also Known As: 2-((5-(2-Chloroethyl)-4-methyl-2-thiazolyl)thio)-N,N-diethylethanamine hydrochloride, Ethanamine, 2-((5-(2-chloroethyl)-4-methyl-2-thiazolyl)thio)-N,N-diethyl-, monohydrochloride, 2-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethyl-diethylazanium chloride, ETHANAMINE, 2-((5-(2-CHLOROETHYL)-4-METHYL-2-THIAZOLYL)THIO)-N,N-DIETHYL-, MONOH, RefChem:339811
| Molecular Formula | C12H22Cl2N2S2 |
|---|---|
| Molecular Weight | 328.06 g/mol |
| LogP | -0.75 |
| Topological Polar Surface Area | 70.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 328.06015 |
| Heavy Atoms | 18 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 74277-03-5 |
|---|---|
| SMILES | CC[NH+](CC)CCSC1=NC(=C(S1)CCCl)C.[Cl-] |
| InChIKey | ZZRLGDLIAKWSRN-UHFFFAOYSA-N |
Product Overview
RefChem:339811 (CAS 74277-03-5), with molecular formula C12H22Cl2N2S2 and molecular weight 328.06 g/mol. IUPAC: 2-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]ethyl-diethylazanium chloride.
Chemical Property Profile of RefChem:339811
Property Insights of RefChem:339811
The XLogP value of -0.75 indicates that RefChem:339811 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:339811. Following Lipinski's Rule of Five, RefChem:339811 has 1 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 RefChem:339811?
The CAS number of RefChem:339811 is 74277-03-5.
What is the molecular formula of RefChem:339811?
The molecular formula of RefChem:339811 is C12H22Cl2N2S2.
What is the molecular weight of RefChem:339811?
The molecular weight of RefChem:339811 is 328.06 g/mol.
Where can I buy RefChem:339811?
You can request a quote for RefChem:339811 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339811?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339811 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.