A0537/0024751
TL;DR: A0537/0024751 (CAS 339098-97-4) is a chemical compound with molecular formula C17H13BrF3N3O2 and molecular weight 427.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(3-bromophenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide
Also Known As: A0537/0024751, 3-Oxo-3-[[3-(trifluoromethyl)phenyl]amino]propanoic acid 2-[(3-bromophenyl)methylene]hydrazide, 3-{2-[(3-Bromophenyl)methylidene]hydrazinyl}-3-oxo-N-[3-(trifluoromethyl)phenyl]propanamide, N'-[(3-bromophenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide
| Molecular Formula | C17H13BrF3N3O2 |
|---|---|
| Molecular Weight | 427.01 g/mol |
| LogP | 3.9468 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.0143 |
| Heavy Atoms | 26 |
| Complexity | 837.998 |
Chemical Identifiers
| CAS Number | 339098-97-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C=NNC(=O)CC(=O)NC2=CC=CC(=C2)C(F)(F)F |
Product Overview
A0537/0024751 (CAS 339098-97-4), with molecular formula C17H13BrF3N3O2 and molecular weight 427.01 g/mol. IUPAC: N'-[(3-bromophenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide.
Chemical Property Profile of A0537/0024751
Property Insights of A0537/0024751
The XLogP value of 3.9468 indicates that A0537/0024751 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for A0537/0024751. Following Lipinski's Rule of Five, A0537/0024751 has 2 hydrogen bond donor(s) and 3 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 A0537/0024751?
The CAS number of A0537/0024751 is 339098-97-4.
What is the molecular formula of A0537/0024751?
The molecular formula of A0537/0024751 is C17H13BrF3N3O2.
What is the molecular weight of A0537/0024751?
The molecular weight of A0537/0024751 is 427.01 g/mol.
Where can I buy A0537/0024751?
You can request a quote for A0537/0024751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0537/0024751?
Yes, KEHONG BIO provides custom synthesis services for A0537/0024751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.