nitricacid,3-2-tert-butyl-1- guanidine
TL;DR: nitricacid,3-2-tert-butyl-1- guanidine (CAS 72042-10-5) is a chemical compound with molecular formula C20H27N7O6S and molecular weight 493.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-1-(2-propan-2-ylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine;bis(nitric acid)
Also Known As: nitricacid,3-2-tert-butyl-1- guanidine, Guanidine, 1-tert-butyl-2-(2-isopropyl-4-quinolyl)-3-(2-thiazolyl)-, dinitrate, Guanidine, N-(1,1-dimethylethyl)-N'-(2-(1-methylethyl)-4-quinolinyl)-N''-2-thiazolyl-, dinitrate, 2-tert-butyl-1-(2-propan-2-ylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine,nitric acid, 2-tert-butyl-1-(2-propan-2-ylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine; nitric acid
| Molecular Formula | C20H27N7O6S |
|---|---|
| Molecular Weight | 493.17 g/mol |
| LogP | 4.7978 |
| Topological Polar Surface Area | 188.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 493.17435 |
| Heavy Atoms | 34 |
| Complexity | 1094.2977 |
Chemical Identifiers
| CAS Number | 72042-10-5 |
|---|---|
| SMILES | CC(C)C1=NC2=CC=CC=C2C(=C1)NC(=NC(C)(C)C)NC3=NC=CS3.[N+](=O)(O)[O-].[N+](=O)(O)[O-] |
Product Overview
nitricacid,3-2-tert-butyl-1- guanidine (CAS 72042-10-5), with molecular formula C20H27N7O6S and molecular weight 493.17 g/mol. IUPAC: 2-tert-butyl-1-(2-propan-2-ylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine;bis(nitric acid).
Chemical Property Profile of nitricacid,3-2-tert-butyl-1- guanidine
Property Insights of nitricacid,3-2-tert-butyl-1- guanidine
The XLogP value of 4.7978 indicates that nitricacid,3-2-tert-butyl-1- guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 188.94 Ų indicates high polarity, suggesting nitricacid,3-2-tert-butyl-1- guanidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, nitricacid,3-2-tert-butyl-1- guanidine has 4 hydrogen bond donor(s) and 8 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 nitricacid,3-2-tert-butyl-1- guanidine?
The CAS number of nitricacid,3-2-tert-butyl-1- guanidine is 72042-10-5.
What is the molecular formula of nitricacid,3-2-tert-butyl-1- guanidine?
The molecular formula of nitricacid,3-2-tert-butyl-1- guanidine is C20H27N7O6S.
What is the molecular weight of nitricacid,3-2-tert-butyl-1- guanidine?
The molecular weight of nitricacid,3-2-tert-butyl-1- guanidine is 493.17 g/mol.
Where can I buy nitricacid,3-2-tert-butyl-1- guanidine?
You can request a quote for nitricacid,3-2-tert-butyl-1- guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for nitricacid,3-2-tert-butyl-1- guanidine?
Yes, KEHONG BIO provides custom synthesis services for nitricacid,3-2-tert-butyl-1- guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.