4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
TL;DR: 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole (CAS 18378-22-8) is a chemical compound with molecular formula C11H12N4O3 and molecular weight 248.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
Also Known As: 4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole, Maybridge1_004814, 4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazole, 4-Piperidino-7-nitrobenzofurazan, 4-Nitro-7-(piperidin-1-yl)benzo[c][1,2,5]oxadiazole
| Molecular Formula | C11H12N4O3 |
|---|---|
| Molecular Weight | 248.09 g/mol |
| LogP | 2.1213 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.09094 |
| Heavy Atoms | 18 |
| Complexity | 588.9859 |
Chemical Identifiers
| CAS Number | 18378-22-8 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC=C(C3=NON=C23)[N+](=O)[O-] |
Product Overview
4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole (CAS 18378-22-8), with molecular formula C11H12N4O3 and molecular weight 248.09 g/mol. IUPAC: 4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole.
Chemical Property Profile of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
Property Insights of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole
The XLogP value of 2.1213 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole. Following Lipinski's Rule of Five, 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole has 0 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 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole?
The CAS number of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole is 18378-22-8.
What is the molecular formula of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole?
The molecular formula of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole is C11H12N4O3.
What is the molecular weight of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole?
The molecular weight of 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole is 248.09 g/mol.
Where can I buy 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole?
You can request a quote for 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-7-piperidin-1-yl-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.