3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide
TL;DR: 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide (CAS 304480-67-9) is a chemical compound with molecular formula C15H10BrN3O5 and molecular weight 390.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide
Also Known As: BAS 00315078, 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide, 3-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide, 3-bromo-N'-[(6-nitro-1,3-benzodioxol-5-yl)methylene]benzohydrazide, 3-Bromo-benzoic acid (6-nitro-benzo[1,3]dioxol-5-ylmethylene)-hydrazide
| Molecular Formula | C15H10BrN3O5 |
|---|---|
| Molecular Weight | 390.98 g/mol |
| LogP | 2.8499 |
| Topological Polar Surface Area | 103.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.98038 |
| Heavy Atoms | 24 |
| Complexity | 852.99835 |
Chemical Identifiers
| CAS Number | 304480-67-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)C3=CC(=CC=C3)Br)[N+](=O)[O-] |
Product Overview
3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide (CAS 304480-67-9), with molecular formula C15H10BrN3O5 and molecular weight 390.98 g/mol. IUPAC: 3-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide.
Chemical Property Profile of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide
Property Insights of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide
The XLogP value of 2.8499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide. The TPSA of 103.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide. Following Lipinski's Rule of Five, 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide has 1 hydrogen bond donor(s) and 6 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 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide?
The CAS number of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide is 304480-67-9.
What is the molecular formula of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide?
The molecular formula of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide is C15H10BrN3O5.
What is the molecular weight of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide?
The molecular weight of 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide is 390.98 g/mol.
Where can I buy 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide?
You can request a quote for 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.