6-Nitro-1,3-benzothiazole-2,5-diamine
TL;DR: 6-Nitro-1,3-benzothiazole-2,5-diamine (CAS 61083-48-5) is a chemical compound with molecular formula C7H6N4O2S and molecular weight 210.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1,3-benzothiazole-2,5-diamine
Also Known As: 6-nitro-1,3-benzothiazole-2,5-diamine, 2,5-Benzothiazolediamine, 6-nitro- (9CI)
| Molecular Formula | C7H6N4O2S |
|---|---|
| Molecular Weight | 210.02 g/mol |
| LogP | 1.3689 |
| Topological Polar Surface Area | 108.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.02115 |
| Heavy Atoms | 14 |
| Complexity | 521.62933 |
Chemical Identifiers
| CAS Number | 61083-48-5 |
|---|---|
| SMILES | C1=C(C(=CC2=C1N=C(S2)N)[N+](=O)[O-])N |
Product Overview
6-Nitro-1,3-benzothiazole-2,5-diamine (CAS 61083-48-5), with molecular formula C7H6N4O2S and molecular weight 210.02 g/mol. IUPAC: 6-nitro-1,3-benzothiazole-2,5-diamine.
Chemical Property Profile of 6-Nitro-1,3-benzothiazole-2,5-diamine
Property Insights of 6-Nitro-1,3-benzothiazole-2,5-diamine
The XLogP value of 1.3689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitro-1,3-benzothiazole-2,5-diamine. The TPSA of 108.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-1,3-benzothiazole-2,5-diamine. Following Lipinski's Rule of Five, 6-Nitro-1,3-benzothiazole-2,5-diamine has 2 hydrogen bond donor(s) and 6 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 6-Nitro-1,3-benzothiazole-2,5-diamine?
The CAS number of 6-Nitro-1,3-benzothiazole-2,5-diamine is 61083-48-5.
What is the molecular formula of 6-Nitro-1,3-benzothiazole-2,5-diamine?
The molecular formula of 6-Nitro-1,3-benzothiazole-2,5-diamine is C7H6N4O2S.
What is the molecular weight of 6-Nitro-1,3-benzothiazole-2,5-diamine?
The molecular weight of 6-Nitro-1,3-benzothiazole-2,5-diamine is 210.02 g/mol.
Where can I buy 6-Nitro-1,3-benzothiazole-2,5-diamine?
You can request a quote for 6-Nitro-1,3-benzothiazole-2,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-1,3-benzothiazole-2,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-1,3-benzothiazole-2,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.