1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide
TL;DR: 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide (CAS 125629-11-0) is a chemical compound with molecular formula C9H8BrN3O4S and molecular weight 332.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-amino-1,3-thiazol-4-yl)-3-nitrobenzene-1,2-diol;hydrobromide
Also Known As: 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide, 5-(2-Amino-4-thiazolyl)-3-nitro-1,2-benzenediol monohydrobromide, 5-(2-amino-4-thiazolyl)-3-nitropyrocatechol hydrobromide, 5-(2-amino-1,3-thiazol-4-yl)-3-nitrobenzene-1,2-diol hydrobromide, 5-(2-amino-1,3-thiazol-4-yl)-3-nitrobenzene-1,2-diol,hydrobromide
| Molecular Formula | C9H8BrN3O4S |
|---|---|
| Molecular Weight | 332.94 g/mol |
| LogP | 2.2896 |
| Topological Polar Surface Area | 122.51 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.9419 |
| Heavy Atoms | 18 |
| Complexity | 601.49384 |
Chemical Identifiers
| CAS Number | 125629-11-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C2=CSC(=N2)N.Br |
Product Overview
1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide (CAS 125629-11-0), with molecular formula C9H8BrN3O4S and molecular weight 332.94 g/mol. IUPAC: 5-(2-amino-1,3-thiazol-4-yl)-3-nitrobenzene-1,2-diol;hydrobromide.
Chemical Property Profile of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide
Property Insights of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide
The XLogP value of 2.2896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide. The TPSA of 122.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide. Following Lipinski's Rule of Five, 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide has 3 hydrogen bond donor(s) and 7 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 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide?
The CAS number of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide is 125629-11-0.
What is the molecular formula of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide?
The molecular formula of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide is C9H8BrN3O4S.
What is the molecular weight of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide?
The molecular weight of 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide is 332.94 g/mol.
Where can I buy 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide?
You can request a quote for 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.