Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-
TL;DR: Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- (CAS 65427-72-7) is a chemical compound with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-benzylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazole
Also Known As: Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-, 7-(4-benzylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazole, 4-Nitro-7-(4-(phenylmethyl)-1-piperazinyl)benzofurazan, 4-(4-benzylpiperazin-1-yl)-7-nitro-2,1,3-benzoxadiazole
| Molecular Formula | C17H17N5O3 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.13315 |
| Heavy Atoms | 25 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 65427-72-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C4=NON=C34)[N+](=O)[O-] |
| InChIKey | FBKLQNWRNMAHCT-UHFFFAOYSA-N |
Product Overview
Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- (CAS 65427-72-7), with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol. IUPAC: 7-(4-benzylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazole.
Chemical Property Profile of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-
Property Insights of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-. Following Lipinski's Rule of Five, Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- 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 Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-?
The CAS number of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- is 65427-72-7.
What is the molecular formula of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-?
The molecular formula of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- is C17H17N5O3.
What is the molecular weight of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-?
The molecular weight of Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- is 339.13 g/mol.
Where can I buy Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-?
You can request a quote for Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzofurazan, 4-nitro-7-(4-(phenylmethyl)-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.