Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide
TL;DR: Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide (CAS 61785-72-6) is a chemical compound with molecular formula C17H17N5O5 and molecular weight 371.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(3-methoxyphenyl)piperazin-1-yl]-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
Also Known As: B-2772, BENZOFURAZAN, 7-(4-(3-METHOXYPHENYL)-1-PIPERAZINYL)-4-NITRO-, 1-OXIDE, 7-(4-(3-Methoxyphenyl)-1-piperazinyl)-4-nitrobenzofurazan 1-oxide, 7-[4-(3-Methoxyphenyl)-1-piperazinyl]-4-nitrobenzofurazane 1-oxide, 7-[4-(3-Methoxyphenyl)piperazin-1-yl]-4-nitro-1-oxido-2,1,3-benzoxadiazol-1-ium
| Molecular Formula | C17H17N5O5 |
|---|---|
| Molecular Weight | 371.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.12296 |
| Heavy Atoms | 27 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 61785-72-6 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=C(C4=NO[N+](=C34)[O-])[N+](=O)[O-] |
| InChIKey | PEXDBFGSQYSJFM-UHFFFAOYSA-N |
Product Overview
Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide (CAS 61785-72-6), with molecular formula C17H17N5O5 and molecular weight 371.12 g/mol. IUPAC: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium.
Chemical Property Profile of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide
Property Insights of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide. Following Lipinski's Rule of Five, Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide has 0 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 Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide?
The CAS number of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide is 61785-72-6.
What is the molecular formula of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide?
The molecular formula of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide is C17H17N5O5.
What is the molecular weight of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide?
The molecular weight of Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide is 371.12 g/mol.
Where can I buy Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide?
You can request a quote for Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Benzofurazan, 7-(4-(3-methoxyphenyl)-1-piperazinyl)-4-nitro-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.