(E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide
TL;DR: (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide (CAS 372087-44-0) is a chemical compound with molecular formula C15H10BrF3N2O2S and molecular weight 417.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(E)-(4,4,4-trifluoro-1-oxo-1-thiophen-2-ylbutan-2-ylidene)amino]benzamide
Also Known As: (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide, 3-bromo-N'-[(2E)-4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene]benzohydrazide, 3-bromo-N-[(E)-(4,4,4-trifluoro-1-oxo-1-thiophen-2-ylbutan-2-ylidene)amino]benzamide
| Molecular Formula | C15H10BrF3N2O2S |
|---|---|
| Molecular Weight | 417.96 g/mol |
| LogP | 4.4317 |
| Topological Polar Surface Area | 58.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.95984 |
| Heavy Atoms | 24 |
| Complexity | 773.27637 |
Chemical Identifiers
| CAS Number | 372087-44-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)N/N=C(\CC(F)(F)F)/C(=O)C2=CC=CS2 |
Product Overview
(E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide (CAS 372087-44-0), with molecular formula C15H10BrF3N2O2S and molecular weight 417.96 g/mol. IUPAC: 3-bromo-N-[(E)-(4,4,4-trifluoro-1-oxo-1-thiophen-2-ylbutan-2-ylidene)amino]benzamide.
Chemical Property Profile of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide
Property Insights of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide
The XLogP value of 4.4317 indicates that (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.53 Ų, (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide 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 (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide?
The CAS number of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide is 372087-44-0.
What is the molecular formula of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide?
The molecular formula of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide is C15H10BrF3N2O2S.
What is the molecular weight of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide?
The molecular weight of (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide is 417.96 g/mol.
Where can I buy (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide?
You can request a quote for (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-bromo-N'-(4,4,4-trifluoro-1-oxo-1-(thiophen-2-yl)butan-2-ylidene)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.