4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole
TL;DR: 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole (CAS 332164-24-6) is a chemical compound with molecular formula C16H21N5O3 and molecular weight 331.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole
Also Known As: BAS 01237185, 4-nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole, 4-Nitro-5,7-di-piperidin-1-yl-benzo[1,2,5]oxadiazole, 4-nitro-5,7-di(piperidin-1-yl)benzo[c][1,2,5]oxadiazole
| Molecular Formula | C16H21N5O3 |
|---|---|
| Molecular Weight | 331.16 g/mol |
| LogP | 3.1116 |
| Topological Polar Surface Area | 88.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.16443 |
| Heavy Atoms | 24 |
| Complexity | 747.496 |
Chemical Identifiers
| CAS Number | 332164-24-6 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCCCC4 |
Product Overview
4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole (CAS 332164-24-6), with molecular formula C16H21N5O3 and molecular weight 331.16 g/mol. IUPAC: 4-nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole.
Chemical Property Profile of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole
Property Insights of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole
The XLogP value of 3.1116 indicates that 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole. Following Lipinski's Rule of Five, 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole has 0 hydrogen bond donor(s) and 7 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-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole?
The CAS number of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole is 332164-24-6.
What is the molecular formula of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole?
The molecular formula of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole is C16H21N5O3.
What is the molecular weight of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole?
The molecular weight of 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole is 331.16 g/mol.
Where can I buy 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole?
You can request a quote for 4-Nitro-5,7-di(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-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-5,7-di(piperidin-1-yl)-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.