![4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid structure](/static/products/380/380216-26-2.png)
4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid
TL;DR: 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid (CAS 380216-26-2) is a chemical compound with molecular formula C15H11N3O6 and molecular weight 329.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzoic acid
Also Known As: 4-[2-[(6-nitrobenzo[1,3]dioxol-5-yl)methylidene]hydrazinyl]benzoic Acid, 4-{2-[(6-nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid
| Molecular Formula | C15H11N3O6 |
|---|---|
| Molecular Weight | 329.06 g/mol |
| LogP | 2.4677 |
| Topological Polar Surface Area | 123.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.0648 |
| Heavy Atoms | 24 |
| Complexity | 831.8482 |
Chemical Identifiers
| CAS Number | 380216-26-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)/C=N/NC3=CC=C(C=C3)C(=O)O)[N+](=O)[O-] |
Product Overview
4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid (CAS 380216-26-2), with molecular formula C15H11N3O6 and molecular weight 329.06 g/mol. IUPAC: 4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzoic acid.
Chemical Property Profile of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid
Property Insights of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid
The XLogP value of 2.4677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid. The TPSA of 123.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid. Following Lipinski's Rule of Five, 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid has 2 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-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid?
The CAS number of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid is 380216-26-2.
What is the molecular formula of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid?
The molecular formula of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid is C15H11N3O6.
What is the molecular weight of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid?
The molecular weight of 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid is 329.06 g/mol.
Where can I buy 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid?
You can request a quote for 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{2-[(6-Nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-yl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.