RefChem:1091067
TL;DR: RefChem:1091067 (CAS 71080-05-2) is a chemical compound with molecular formula C19H23N5S and molecular weight 353.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylbutan-2-yl)-2-(2-methylquinolin-4-yl)-1-(1,3-thiazol-2-yl)guanidine
Also Known As: 1-tert-Pentyl-2-(2-methyl-4-quinolyl)-3-(2-thiazolyl)guanidine, GUANIDINE, 1-tert-PENTYL-2-(2-METHYL-4-QUINOLYL)-3-(2-THIAZOLYL)-, N-(2-Methylbutan-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)-N-1,3-thiazol-2-ylguanidine, 1-(2-methylbutan-2-yl)-2-(2-methylquinolin-4-yl)-1-(1,3-thiazol-2-yl)guanidine, N-(2-Methylbutan-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)-N-(1,3-thiazol-2-yl)guanidine
| Molecular Formula | C19H23N5S |
|---|---|
| Molecular Weight | 353.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.16742 |
| Heavy Atoms | 25 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 71080-05-2 |
|---|---|
| SMILES | CCC(C)(C)N(C1=NC=CS1)C(=NC2=CC(=NC3=CC=CC=C32)C)N |
| InChIKey | ZSAMYHHESBMROH-UHFFFAOYSA-N |
Product Overview
RefChem:1091067 (CAS 71080-05-2), with molecular formula C19H23N5S and molecular weight 353.17 g/mol. IUPAC: 1-(2-methylbutan-2-yl)-2-(2-methylquinolin-4-yl)-1-(1,3-thiazol-2-yl)guanidine.
Chemical Property Profile of RefChem:1091067
Property Insights of RefChem:1091067
The XLogP value of 4.1 indicates that RefChem:1091067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1091067. Following Lipinski's Rule of Five, RefChem:1091067 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:1091067?
The CAS number of RefChem:1091067 is 71080-05-2.
What is the molecular formula of RefChem:1091067?
The molecular formula of RefChem:1091067 is C19H23N5S.
What is the molecular weight of RefChem:1091067?
The molecular weight of RefChem:1091067 is 353.17 g/mol.
Where can I buy RefChem:1091067?
You can request a quote for RefChem:1091067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091067?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.