7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole
TL;DR: 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole (CAS 713084-65-2) is a chemical compound with molecular formula C12H13ClN4O3 and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole
Also Known As: 7-chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole, 7-chloro-5-(2-methylpiperidin-1-yl)-4-nitrobenzo[c][1,2,5]oxadiazole
| Molecular Formula | C12H13ClN4O3 |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 3.1632 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.06763 |
| Heavy Atoms | 20 |
| Complexity | 672.01135 |
Chemical Identifiers
| CAS Number | 713084-65-2 |
|---|---|
| SMILES | CC1CCCCN1C2=C(C3=NON=C3C(=C2)Cl)[N+](=O)[O-] |
Product Overview
7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole (CAS 713084-65-2), with molecular formula C12H13ClN4O3 and molecular weight 296.07 g/mol. IUPAC: 7-chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole.
Chemical Property Profile of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole
Property Insights of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole
The XLogP value of 3.1632 indicates that 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole. Following Lipinski's Rule of Five, 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-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 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole?
The CAS number of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole is 713084-65-2.
What is the molecular formula of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole?
The molecular formula of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole is C12H13ClN4O3.
What is the molecular weight of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole?
The molecular weight of 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole is 296.07 g/mol.
Where can I buy 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole?
You can request a quote for 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-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 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-5-(2-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.