N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine
TL;DR: N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine (CAS 71079-27-1) is a chemical compound with molecular formula C21H25N5S and molecular weight 379.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-(3-methyl-1,2-thiazol-5-yl)guanidine
Also Known As: N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine, Guanidine, N-cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)-, Guanidine, 1-cyclohexyl-2-(2-methyl-4-quinolyl)-3-(3-methyl-5-isothiazolyl)-, 2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-(3-methyl-1,2-thiazol-5-yl)guanidine, N''-Cyclohexyl-N-(2-methylquinolin-4(1H)-ylidene)-N'-(3-methyl-1,2-thiazol-5-yl)guanidine
| Molecular Formula | C21H25N5S |
|---|---|
| Molecular Weight | 379.18 g/mol |
| LogP | 5.52084 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.18307 |
| Heavy Atoms | 27 |
| Complexity | 956.1153 |
Chemical Identifiers
| CAS Number | 71079-27-1 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)NC(=NC3CCCCC3)NC4=CC(=NS4)C |
Product Overview
N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine (CAS 71079-27-1), with molecular formula C21H25N5S and molecular weight 379.18 g/mol. IUPAC: 2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-(3-methyl-1,2-thiazol-5-yl)guanidine.
Chemical Property Profile of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine
Property Insights of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine
The XLogP value of 5.52084 indicates that N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine 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 N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine. Following Lipinski's Rule of Five, N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine 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 N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine?
The CAS number of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine is 71079-27-1.
What is the molecular formula of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine?
The molecular formula of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine is C21H25N5S.
What is the molecular weight of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine?
The molecular weight of N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine is 379.18 g/mol.
Where can I buy N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine?
You can request a quote for N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.