2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-
TL;DR: 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- (CAS 53552-20-8) is a chemical compound with molecular formula C7H7N3OS and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-5-methyl-2,1,3-benzothiadiazol-4-ol
Also Known As: 2-amino-4-methyl-8, 7-Amino-5-methyl-2,1,3-benzothia(S IV)diazol-4-ol, 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-, 7-amino-5-methyl-2,1,3-benzothiadiazol-4-ol, 7-Amino-5-methyl-2,1,3-benzothiadiazol-SIV-4-ol
| Molecular Formula | C7H7N3OS |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 1.28752 |
| Topological Polar Surface Area | 72.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.03099 |
| Heavy Atoms | 12 |
| Complexity | 437.38925 |
Chemical Identifiers
| CAS Number | 53552-20-8 |
|---|---|
| SMILES | CC1=C(C2=NSN=C2C(=C1)N)O |
Product Overview
2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- (CAS 53552-20-8), with molecular formula C7H7N3OS and molecular weight 181.03 g/mol. IUPAC: 7-amino-5-methyl-2,1,3-benzothiadiazol-4-ol.
Chemical Property Profile of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-
Property Insights of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-
The XLogP value of 1.28752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-. The TPSA of 72.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-. Following Lipinski's Rule of Five, 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- has 2 hydrogen bond donor(s) and 5 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 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-?
The CAS number of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- is 53552-20-8.
What is the molecular formula of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-?
The molecular formula of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- is C7H7N3OS.
What is the molecular weight of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-?
The molecular weight of 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- is 181.03 g/mol.
Where can I buy 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-?
You can request a quote for 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,1,3-Benzothia(S IV)diazol-4-ol, 7-amino-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.