AN-329/40901118
TL;DR: AN-329/40901118 (CAS 458552-87-9) is a chemical compound with molecular formula C20H21Br2N3O4 and molecular weight 524.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[2-(2,4-dibromophenoxy)acetyl]hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxobutanamide
Also Known As: AN-329/40901118, 4-{2-[(2,4-dibromophenoxy)acetyl]hydrazino}-N-(2,5-dimethylphenyl)-4-oxobutanamide, 4-[2-[2-(2,4-dibromophenoxy)acetyl]hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxobutanamide, 4-{2-[(2,4-dibromophenoxy)acetyl]hydrazinyl}-N-(2,5-dimethylphenyl)-4-oxobutanamide
| Molecular Formula | C20H21Br2N3O4 |
|---|---|
| Molecular Weight | 524.99 g/mol |
| LogP | 3.77354 |
| Topological Polar Surface Area | 96.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 524.98987 |
| Heavy Atoms | 29 |
| Complexity | 918.5945 |
Chemical Identifiers
| CAS Number | 458552-87-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NNC(=O)COC2=C(C=C(C=C2)Br)Br |
Product Overview
AN-329/40901118 (CAS 458552-87-9), with molecular formula C20H21Br2N3O4 and molecular weight 524.99 g/mol. IUPAC: 4-[2-[2-(2,4-dibromophenoxy)acetyl]hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxobutanamide.
Chemical Property Profile of AN-329/40901118
Property Insights of AN-329/40901118
The XLogP value of 3.77354 indicates that AN-329/40901118 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/40901118. Following Lipinski's Rule of Five, AN-329/40901118 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-329/40901118?
The CAS number of AN-329/40901118 is 458552-87-9.
What is the molecular formula of AN-329/40901118?
The molecular formula of AN-329/40901118 is C20H21Br2N3O4.
What is the molecular weight of AN-329/40901118?
The molecular weight of AN-329/40901118 is 524.99 g/mol.
Where can I buy AN-329/40901118?
You can request a quote for AN-329/40901118 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40901118?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40901118 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.