RefChem:1086321
TL;DR: RefChem:1086321 (CAS 71079-21-5) is a chemical compound with molecular formula C22H27N5S and molecular weight 393.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclohexyl-1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methylquinolin-4-yl)guanidine
Also Known As: Guanidine, N-cyclohexyl-N'-(4,5-dimethyl-2-thiazolyl)-N''-(2-methyl-4-quinolinyl)-, N-Cyclohexyl-N'-(4,5-dimethyl-2-thiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine, Guanidine, 1-cyclohexyl-3,(4,5-dimethyl-2-thiazolyl)-2-(2-methyl-4-quinolyl)-, 2-cyclohexyl-1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methylquinolin-4-yl)guanidine, N-Cyclohexyl-N'-(4,5-dimethyl-thiazol-2-yl)-N''-(2-methyl-quinolin-4-yl)-guanidine
| Molecular Formula | C22H27N5S |
|---|---|
| Molecular Weight | 393.20 g/mol |
| LogP | 5.82926 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.19873 |
| Heavy Atoms | 28 |
| Complexity | 981.8298 |
Chemical Identifiers
| CAS Number | 71079-21-5 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)NC(=NC3CCCCC3)NC4=NC(=C(S4)C)C |
Product Overview
RefChem:1086321 (CAS 71079-21-5), with molecular formula C22H27N5S and molecular weight 393.20 g/mol. IUPAC: 2-cyclohexyl-1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methylquinolin-4-yl)guanidine.
Chemical Property Profile of RefChem:1086321
Property Insights of RefChem:1086321
The XLogP value of 5.82926 indicates that RefChem:1086321 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1086321. Following Lipinski's Rule of Five, RefChem:1086321 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1086321?
The CAS number of RefChem:1086321 is 71079-21-5.
What is the molecular formula of RefChem:1086321?
The molecular formula of RefChem:1086321 is C22H27N5S.
What is the molecular weight of RefChem:1086321?
The molecular weight of RefChem:1086321 is 393.20 g/mol.
Where can I buy RefChem:1086321?
You can request a quote for RefChem:1086321 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086321?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086321 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.