Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-
TL;DR: Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- (CAS 75472-45-6) is a chemical compound with molecular formula C8H8N4O6S and molecular weight 288.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethanesulfonic acid
Also Known As: N-(7-nitrobenzo-furazan-4-yl)taurine, 2-((7-Nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)ethanesulfonic acid, 2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethanesulfonic acid, Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-, 2-[(7-Nitrobenzofurazan-4-yl)amino]ethanesulfonic acid
| Molecular Formula | C8H8N4O6S |
|---|---|
| Molecular Weight | 288.02 g/mol |
| LogP | 0.4307 |
| Topological Polar Surface Area | 148.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.01645 |
| Heavy Atoms | 19 |
| Complexity | 723.9144 |
Chemical Identifiers
| CAS Number | 75472-45-6 |
|---|---|
| SMILES | C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCS(=O)(=O)O |
Product Overview
Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- (CAS 75472-45-6), with molecular formula C8H8N4O6S and molecular weight 288.02 g/mol. IUPAC: 2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethanesulfonic acid.
Chemical Property Profile of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-
Property Insights of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-
The XLogP value of 0.4307 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-. The TPSA of 148.46 Ų indicates high polarity, suggesting Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- has 2 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 Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-?
The CAS number of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- is 75472-45-6.
What is the molecular formula of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-?
The molecular formula of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- is C8H8N4O6S.
What is the molecular weight of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-?
The molecular weight of Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- is 288.02 g/mol.
Where can I buy Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-?
You can request a quote for Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanesulfonic acid, 2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.