BAS 00281439
TL;DR: BAS 00281439 (CAS 330569-24-9) is a chemical compound with molecular formula C21H15ClIN5O5 and molecular weight 578.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-iodophenoxy)-N-[[2-hydroxy-5-[(4-nitrophenyl)diazenyl]phenyl]methylideneamino]acetamide
Also Known As: BAS 00281439, Acetic acid, 2-(4-chloro-2-iodophenoxy)-, 2-[[2-hydroxy-5-[2-(4-nitrophenyl)diazenyl]phenyl]methylene]hydrazide, 2-(4-chloro-2-iodophenoxy)-N-[[3-[(4-nitrophenyl)hydrazinylidene]-6-oxocyclohexa-1,4-dien-1-yl]methylideneamino]acetamide
| Molecular Formula | C21H15ClIN5O5 |
|---|---|
| Molecular Weight | 578.98 g/mol |
| LogP | 5.5029 |
| Topological Polar Surface Area | 138.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 578.98065 |
| Heavy Atoms | 33 |
| Complexity | 1234.2151 |
Chemical Identifiers
| CAS Number | 330569-24-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=CC(=C(C=C2)O)C=NNC(=O)COC3=C(C=C(C=C3)Cl)I)[N+](=O)[O-] |
Product Overview
BAS 00281439 (CAS 330569-24-9), with molecular formula C21H15ClIN5O5 and molecular weight 578.98 g/mol. IUPAC: 2-(4-chloro-2-iodophenoxy)-N-[[2-hydroxy-5-[(4-nitrophenyl)diazenyl]phenyl]methylideneamino]acetamide.
Chemical Property Profile of BAS 00281439
Property Insights of BAS 00281439
The XLogP value of 5.5029 indicates that BAS 00281439 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00281439. Following Lipinski's Rule of Five, BAS 00281439 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00281439?
The CAS number of BAS 00281439 is 330569-24-9.
What is the molecular formula of BAS 00281439?
The molecular formula of BAS 00281439 is C21H15ClIN5O5.
What is the molecular weight of BAS 00281439?
The molecular weight of BAS 00281439 is 578.98 g/mol.
Where can I buy BAS 00281439?
You can request a quote for BAS 00281439 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00281439?
Yes, KEHONG BIO provides custom synthesis services for BAS 00281439 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.