N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine
TL;DR: N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine (CAS 71079-75-9) is a chemical compound with molecular formula C18H23N5S and molecular weight 341.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-2-(2,3-dihydro-1,3-thiazol-2-yl)-3-(2-methylquinolin-4-yl)guanidine
Also Known As: N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine
| Molecular Formula | C18H23N5S |
|---|---|
| Molecular Weight | 341.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.16742 |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 71079-75-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)NC(=NC3NC=CS3)NC(C)(C)C |
| InChIKey | BTUDHKWPMCEHCY-UHFFFAOYSA-N |
Product Overview
N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine (CAS 71079-75-9), with molecular formula C18H23N5S and molecular weight 341.17 g/mol. IUPAC: 1-tert-butyl-2-(2,3-dihydro-1,3-thiazol-2-yl)-3-(2-methylquinolin-4-yl)guanidine.
Chemical Property Profile of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine
Property Insights of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine
The XLogP value of 3.5 indicates that N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine. Following Lipinski's Rule of Five, N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine has 3 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 N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine?
The CAS number of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine is 71079-75-9.
What is the molecular formula of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine?
The molecular formula of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine is C18H23N5S.
What is the molecular weight of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine?
The molecular weight of N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine is 341.17 g/mol.
Where can I buy N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine?
You can request a quote for N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine 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''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-tert-Butyl-N''-(2,3-dihydro-1,3-thiazol-2-yl)-N'-(2-methylquinolin-4(1H)-ylidene)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.