AT-057/43469588
TL;DR: AT-057/43469588 (CAS 577767-46-5) is a chemical compound with molecular formula C29H30N4O3 and molecular weight 482.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoylamino]benzamide
Also Known As: AT-057/43469588, N,N-diethyl-4-({3-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]propanoyl}amino)benzamide, N,N-diethyl-4-(3-(1-oxo-4-(p-tolyl)phthalazin-2(1H)-yl)propanamido)benzamide, N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxo-phthalazin-2-yl]propanoylamino]benzamide, N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoylamino]benzamide
| Molecular Formula | C29H30N4O3 |
|---|---|
| Molecular Weight | 482.23 g/mol |
| LogP | 4.88272 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.23178 |
| Heavy Atoms | 36 |
| Complexity | 1436.6162 |
Chemical Identifiers
| CAS Number | 577767-46-5 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C |
Product Overview
AT-057/43469588 (CAS 577767-46-5), with molecular formula C29H30N4O3 and molecular weight 482.23 g/mol. IUPAC: N,N-diethyl-4-[3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoylamino]benzamide.
Chemical Property Profile of AT-057/43469588
Property Insights of AT-057/43469588
The XLogP value of 4.88272 indicates that AT-057/43469588 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AT-057/43469588. Following Lipinski's Rule of Five, AT-057/43469588 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 AT-057/43469588?
The CAS number of AT-057/43469588 is 577767-46-5.
What is the molecular formula of AT-057/43469588?
The molecular formula of AT-057/43469588 is C29H30N4O3.
What is the molecular weight of AT-057/43469588?
The molecular weight of AT-057/43469588 is 482.23 g/mol.
Where can I buy AT-057/43469588?
You can request a quote for AT-057/43469588 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AT-057/43469588?
Yes, KEHONG BIO provides custom synthesis services for AT-057/43469588 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.