2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol
TL;DR: 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol (CAS 332164-30-4) is a chemical compound with molecular formula C9H11N5O4 and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol
Also Known As: BAS 01237201, 2-[(5-amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol, 2-[{6-amino-7-nitro-2,1,3-benzoxadiazol-4-yl}(methyl)amino]ethanol, 2-((6-amino-7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)(methyl)amino)ethanol, 2-[(6-amino-7-nitro-2,1,3-benzoxadiazol-4-yl)(methyl)amino]ethanol
| Molecular Formula | C9H11N5O4 |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 0.1417 |
| Topological Polar Surface Area | 131.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.0811 |
| Heavy Atoms | 18 |
| Complexity | 595.9007 |
Chemical Identifiers
| CAS Number | 332164-30-4 |
|---|---|
| SMILES | CN(CCO)C1=CC(=C(C2=NON=C12)[N+](=O)[O-])N |
Product Overview
2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol (CAS 332164-30-4), with molecular formula C9H11N5O4 and molecular weight 253.08 g/mol. IUPAC: 2-[(5-amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol.
Chemical Property Profile of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol
Property Insights of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol
The XLogP value of 0.1417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol. The TPSA of 131.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol. Following Lipinski's Rule of Five, 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol 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 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol?
The CAS number of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol is 332164-30-4.
What is the molecular formula of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol?
The molecular formula of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol is C9H11N5O4.
What is the molecular weight of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol?
The molecular weight of 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol is 253.08 g/mol.
Where can I buy 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol?
You can request a quote for 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Amino-4-nitro-2,1,3-benzoxadiazol-7-yl)-methylamino]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.