2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone
TL;DR: 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone (CAS 473421-52-2) is a chemical compound with molecular formula C22H15N3O5 and molecular weight 401.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-nitro-1,3-benzodioxol-5-yl)methylidenehydrazinylidene]-1,2-diphenylethanone
Also Known As: 2-[(6-nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone, 2-[(6-nitro-1,3-benzodioxol-5-yl)methylidenehydrazinylidene]-1,2-diphenylethanone, (2e)-2-[(2e)-2-[(6-nitro-1,3-dioxaindan-5-yl)methylidene]hydrazin-1-ylidene]-1,2-diphenylethan-1-one
| Molecular Formula | C22H15N3O5 |
|---|---|
| Molecular Weight | 401.10 g/mol |
| LogP | 4.0296 |
| Topological Polar Surface Area | 103.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.10117 |
| Heavy Atoms | 30 |
| Complexity | 1158.1504 |
Chemical Identifiers
| CAS Number | 473421-52-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NN=C(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-] |
Product Overview
2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone (CAS 473421-52-2), with molecular formula C22H15N3O5 and molecular weight 401.10 g/mol. IUPAC: 2-[(6-nitro-1,3-benzodioxol-5-yl)methylidenehydrazinylidene]-1,2-diphenylethanone.
Chemical Property Profile of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone
Property Insights of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone
The XLogP value of 4.0296 indicates that 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone. Following Lipinski's Rule of Five, 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone 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 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone?
The CAS number of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone is 473421-52-2.
What is the molecular formula of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone?
The molecular formula of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone is C22H15N3O5.
What is the molecular weight of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone?
The molecular weight of 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone is 401.10 g/mol.
Where can I buy 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone?
You can request a quote for 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-Nitro-1,3-benzodioxol-5-yl)methylenehydrazono]-1,2-diphenyl-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.