AN-023/13174001
TL;DR: AN-023/13174001 (CAS 328968-74-7) is a chemical compound with molecular formula C18H15BrFN3O2 and molecular weight 403.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione
Also Known As: AN-023/13174001, (4Z)-4-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione, 4-[3-bromo-4-(dimethylamino)benzylidene]-1-(4-fluorophenyl)-3,5-pyrazolidinedione, (4Z)-4-[3-bromo-4-(dimethylamino)benzylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione
| Molecular Formula | C18H15BrFN3O2 |
|---|---|
| Molecular Weight | 403.03 g/mol |
| LogP | 3.1156 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 403.03317 |
| Heavy Atoms | 25 |
| Complexity | 878.38995 |
Chemical Identifiers
| CAS Number | 328968-74-7 |
|---|---|
| SMILES | CN(C)C1=C(C=C(C=C1)/C=C\2/C(=O)NN(C2=O)C3=CC=C(C=C3)F)Br |
Product Overview
AN-023/13174001 (CAS 328968-74-7), with molecular formula C18H15BrFN3O2 and molecular weight 403.03 g/mol. IUPAC: (4Z)-4-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-(4-fluorophenyl)pyrazolidine-3,5-dione.
Chemical Property Profile of AN-023/13174001
Property Insights of AN-023/13174001
The XLogP value of 3.1156 indicates that AN-023/13174001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, AN-023/13174001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-023/13174001 has 1 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 AN-023/13174001?
The CAS number of AN-023/13174001 is 328968-74-7.
What is the molecular formula of AN-023/13174001?
The molecular formula of AN-023/13174001 is C18H15BrFN3O2.
What is the molecular weight of AN-023/13174001?
The molecular weight of AN-023/13174001 is 403.03 g/mol.
Where can I buy AN-023/13174001?
You can request a quote for AN-023/13174001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-023/13174001?
Yes, KEHONG BIO provides custom synthesis services for AN-023/13174001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.