N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine
TL;DR: N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine (CAS 71079-97-5) is a chemical compound with molecular formula C23H23N5S and molecular weight 401.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-1-(2-phenylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine
Also Known As: Guanidine, 1-tert-butyl-2-(2-phenyl-4-quinolyl)-3-(2-thiazolyl)-, 1-(tert-butyl)-2-(2-phenylquinolin-4-yl)-3-(thiazol-2-yl)guanidine, N-(1,1-Dimethylethyl)-N'-(2-phenyl-4-quinolinyl)-N''-2-thiazolylguanidine, Guanidine, N-(1,1-dimethylethyl)-N'-(2-phenyl-4-quinolinyl)-N''-2-thiazolyl-, N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine
| Molecular Formula | C23H23N5S |
|---|---|
| Molecular Weight | 401.17 g/mol |
| LogP | 6.0368 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.16742 |
| Heavy Atoms | 29 |
| Complexity | 1129.122 |
Chemical Identifiers
| CAS Number | 71079-97-5 |
|---|---|
| SMILES | CC(C)(C)N=C(NC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3)NC4=NC=CS4 |
Product Overview
N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine (CAS 71079-97-5), with molecular formula C23H23N5S and molecular weight 401.17 g/mol. IUPAC: 2-tert-butyl-1-(2-phenylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine.
Chemical Property Profile of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine
Property Insights of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine
The XLogP value of 6.0368 indicates that N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine 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-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine. Following Lipinski's Rule of Five, N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine 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-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine?
The CAS number of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine is 71079-97-5.
What is the molecular formula of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine?
The molecular formula of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine is C23H23N5S.
What is the molecular weight of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine?
The molecular weight of N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine is 401.17 g/mol.
Where can I buy N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine?
You can request a quote for N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine?
Yes, KEHONG BIO provides custom synthesis services for N-tert-Butyl-N'-(2-phenylquinolin-4(1H)-ylidene)-N''-1,3-thiazol-2-ylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.