AC 55541
TL;DR: AC 55541 (CAS 916170-19-9) is a chemical compound with molecular formula C25H20BrN5O3 and molecular weight 517.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-[1-(3-bromophenyl)ethylidene]hydrazinyl]-2-oxo-1-(4-oxo-3H-phthalazin-1-yl)ethyl]benzamide
Also Known As: AC 55541, BAS 00063877, N-[2-[(2Z)-2-[1-(3-bromophenyl)ethylidene]hydrazinyl]-2-oxo-1-(4-oxo-3H-phthalazin-1-yl)ethyl]benzamide, N-[2-[2-[1-(3-bromophenyl)ethylidene]hydrazinyl]-2-oxo-1-(4-oxo-3H-phthalazin-1-yl)ethyl]benzamide, (E)-N-(2-(2-(1-(3-Bromophenyl)ethylidene)hydrazineyl)-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl)benzamide
| Molecular Formula | C25H20BrN5O3 |
|---|---|
| Molecular Weight | 517.07 g/mol |
| LogP | 3.6971 |
| Topological Polar Surface Area | 116.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 517.07495 |
| Heavy Atoms | 34 |
| Complexity | 1449.9174 |
Chemical Identifiers
| CAS Number | 916170-19-9 |
|---|---|
| SMILES | CC(=NNC(=O)C(C1=NNC(=O)C2=CC=CC=C21)NC(=O)C3=CC=CC=C3)C4=CC(=CC=C4)Br |
Product Overview
AC 55541 (CAS 916170-19-9), with molecular formula C25H20BrN5O3 and molecular weight 517.07 g/mol. IUPAC: N-[2-[2-[1-(3-bromophenyl)ethylidene]hydrazinyl]-2-oxo-1-(4-oxo-3H-phthalazin-1-yl)ethyl]benzamide.
Chemical Property Profile of AC 55541
Property Insights of AC 55541
The XLogP value of 3.6971 indicates that AC 55541 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AC 55541. Following Lipinski's Rule of Five, AC 55541 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AC 55541?
The CAS number of AC 55541 is 916170-19-9.
What is the molecular formula of AC 55541?
The molecular formula of AC 55541 is C25H20BrN5O3.
What is the molecular weight of AC 55541?
The molecular weight of AC 55541 is 517.07 g/mol.
Where can I buy AC 55541?
You can request a quote for AC 55541 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AC 55541?
Yes, KEHONG BIO provides custom synthesis services for AC 55541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.