2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride
TL;DR: 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride (CAS 83846-65-5) is a chemical compound with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanone;hydrochloride
Also Known As: EINECS 281-042-9, 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride, 2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanone hydrochloride, 2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanone,hydrochloride, 2-(2-IMINO-THIAZOLIDIN-3-YL)-1-PHENYL-ETHANONE, HYDROCHLORIDE
| Molecular Formula | C11H13ClN2OS |
|---|---|
| Molecular Weight | 256.04 g/mol |
| LogP | 2.27467 |
| Topological Polar Surface Area | 44.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.0437 |
| Heavy Atoms | 16 |
| Complexity | 382.83078 |
Chemical Identifiers
| CAS Number | 83846-65-5 |
|---|---|
| SMILES | C1CSC(=N)N1CC(=O)C2=CC=CC=C2.Cl |
Product Overview
2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride (CAS 83846-65-5), with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol. IUPAC: 2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanone;hydrochloride.
Chemical Property Profile of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride
Property Insights of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride
The XLogP value of 2.27467 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride. With a topological polar surface area (TPSA) of 44.16 Ų, 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride has 1 hydrogen bond donor(s) and 3 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 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride?
The CAS number of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride is 83846-65-5.
What is the molecular formula of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride?
The molecular formula of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride is C11H13ClN2OS.
What is the molecular weight of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride?
The molecular weight of 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride is 256.04 g/mol.
Where can I buy 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride?
You can request a quote for 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Iminothiazolidin-3-yl)-1-phenylethan-1-one monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.