6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid
TL;DR: 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid (CAS 88235-25-0) is a chemical compound with molecular formula C12H14N4O5 and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid
Also Known As: Nbd-amha, NBD Hexanoic Acid, NBD-X acid, NBD-X, 7-Nitrobenzoxadiazole-6-aminohexanoic acid
| Molecular Formula | C12H14N4O5 |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 294.0964 |
| Heavy Atoms | 21 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 88235-25-0 |
|---|---|
| SMILES | C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCCCCC(=O)O |
| InChIKey | DJFNQJJTTPMBIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid (CAS 88235-25-0), with molecular formula C12H14N4O5 and molecular weight 294.10 g/mol. IUPAC: 6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid.
Chemical Property Profile of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid
Property Insights of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid. Following Lipinski's Rule of Five, 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid 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 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid?
The CAS number of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid is 88235-25-0.
What is the molecular formula of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid?
The molecular formula of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid is C12H14N4O5.
What is the molecular weight of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid?
The molecular weight of 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid is 294.10 g/mol.
Where can I buy 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid?
You can request a quote for 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(N-(7-Nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.