Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate
TL;DR: Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate (CAS 71253-70-8) is a chemical compound with molecular formula C19H22N6S2 and molecular weight 398.13 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-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)guanidine
Also Known As: Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate, 2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)guanidine, N''-Cyclohexyl-N-(2-methylquinolin-4-yl)-N'-(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)guanidine, RefChem:346890
| Molecular Formula | C19H22N6S2 |
|---|---|
| Molecular Weight | 398.13 g/mol |
| LogP | 5.27001 |
| Topological Polar Surface Area | 77.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.13474 |
| Heavy Atoms | 27 |
| Complexity | 1016.21185 |
Chemical Identifiers
| CAS Number | 71253-70-8 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)NC(=NC3CCCCC3)NC4=NNC(=S)S4 |
Product Overview
Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate (CAS 71253-70-8), with molecular formula C19H22N6S2 and molecular weight 398.13 g/mol. IUPAC: 2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)guanidine.
Chemical Property Profile of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate
Property Insights of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate
The XLogP value of 5.27001 indicates that Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate. Following Lipinski's Rule of Five, Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate?
The CAS number of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate is 71253-70-8.
What is the molecular formula of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate?
The molecular formula of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate is C19H22N6S2.
What is the molecular weight of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate?
The molecular weight of Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate is 398.13 g/mol.
Where can I buy Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate?
You can request a quote for Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 1-cyclohexyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-, dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.