BAS 00294336
TL;DR: BAS 00294336 (CAS 416883-68-6) is a chemical compound with molecular formula C16H11BrN4O5 and molecular weight 417.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]-2-(2-nitrophenoxy)acetamide
Also Known As: BAS 00294336, BIM-0021875.P001, N'-(5-bromo-2-oxoindol-3-yl)-2-(2-nitrophenoxy)acetohydrazide, (Z)-N'-(5-bromo-2-oxoindolin-3-ylidene)-2-(2-nitrophenoxy)acetohydrazide, N'-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-(2-nitrophenoxy)acetohydrazide
| Molecular Formula | C16H11BrN4O5 |
|---|---|
| Molecular Weight | 417.99 g/mol |
| LogP | 4.2335 |
| Topological Polar Surface Area | 130.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.99127 |
| Heavy Atoms | 26 |
| Complexity | 1030.6521 |
Chemical Identifiers
| CAS Number | 416883-68-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)N=NC2=C(NC3=C2C=C(C=C3)Br)O |
Product Overview
BAS 00294336 (CAS 416883-68-6), with molecular formula C16H11BrN4O5 and molecular weight 417.99 g/mol. IUPAC: N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]-2-(2-nitrophenoxy)acetamide.
Chemical Property Profile of BAS 00294336
Property Insights of BAS 00294336
The XLogP value of 4.2335 indicates that BAS 00294336 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00294336. Following Lipinski's Rule of Five, BAS 00294336 has 2 hydrogen bond donor(s) and 6 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 BAS 00294336?
The CAS number of BAS 00294336 is 416883-68-6.
What is the molecular formula of BAS 00294336?
The molecular formula of BAS 00294336 is C16H11BrN4O5.
What is the molecular weight of BAS 00294336?
The molecular weight of BAS 00294336 is 417.99 g/mol.
Where can I buy BAS 00294336?
You can request a quote for BAS 00294336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00294336?
Yes, KEHONG BIO provides custom synthesis services for BAS 00294336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.