1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-
TL;DR: 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- (CAS 833-63-6) is a chemical compound with molecular formula C8H6N4O2S and molecular weight 222.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-nitrophenyl)-1,3,4-thiadiazol-2-amine
Also Known As: 5-(4-Nitrophenyl)-1,3,4-thiadiazol-2-amine, 2-Amino-5-(4-nitrophenyl)-1,3,4-thiadiazole, 5-(4-Nitro-phenyl)-[1,3,4]thiadiazol-2-ylamine, 2-Amino-5-p-nitrofenil-1,3,4-tiadiazolo, 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-
| Molecular Formula | C8H6N4O2S |
|---|---|
| Molecular Weight | 222.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.02115 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 833-63-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(S2)N)[N+](=O)[O-] |
| InChIKey | XAPNDVNSXWXPJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- (CAS 833-63-6), with molecular formula C8H6N4O2S and molecular weight 222.02 g/mol. IUPAC: 5-(4-nitrophenyl)-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-
Property Insights of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-. Following Lipinski's Rule of Five, 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- has 1 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 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-?
The CAS number of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- is 833-63-6.
What is the molecular formula of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-?
The molecular formula of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- is C8H6N4O2S.
What is the molecular weight of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-?
The molecular weight of 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- is 222.02 g/mol.
Where can I buy 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-?
You can request a quote for 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazole, 2-amino-5-(p-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.