N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide
TL;DR: N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide (CAS 330978-80-8) is a chemical compound with molecular formula C15H11BrN2O3 and molecular weight 346.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide
Also Known As: N'-[(6-bromo-1,3-benzodioxol-5-yl)methylene]benzohydrazide, N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide
| Molecular Formula | C15H11BrN2O3 |
|---|---|
| Molecular Weight | 346.00 g/mol |
| LogP | 2.9417 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.9953 |
| Heavy Atoms | 21 |
| Complexity | 701.56494 |
Chemical Identifiers
| CAS Number | 330978-80-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC=CC=C3)Br |
Product Overview
N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide (CAS 330978-80-8), with molecular formula C15H11BrN2O3 and molecular weight 346.00 g/mol. IUPAC: N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide.
Chemical Property Profile of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide
Property Insights of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide
The XLogP value of 2.9417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide. With a topological polar surface area (TPSA) of 59.92 Ų, N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide has 1 hydrogen bond donor(s) and 4 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 N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide?
The CAS number of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide is 330978-80-8.
What is the molecular formula of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide?
The molecular formula of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide is C15H11BrN2O3.
What is the molecular weight of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide?
The molecular weight of N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide is 346.00 g/mol.
Where can I buy N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide?
You can request a quote for N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.