BAS 00494368
TL;DR: BAS 00494368 (CAS 330562-00-0) is a chemical compound with molecular formula C16H11N5O7 and molecular weight 385.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-5-nitro-1H-indol-3-yl)imino]-2-(2-nitrophenoxy)acetamide
Also Known As: BAS 00494368, N'-[(3Z)-5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(2-nitrophenoxy)acetohydrazide, N'-(5-nitro-2-oxoindol-3-yl)-2-(2-nitrophenoxy)acetohydrazide, (Z)-N'-(5-nitro-2-oxoindolin-3-ylidene)-2-(2-nitrophenoxy)acetohydrazide, N'-(5-Nitro-2-oxoindolin-3-ylidene)-2-(2-nitrophenoxy)acetohydrazide
| Molecular Formula | C16H11N5O7 |
|---|---|
| Molecular Weight | 385.07 g/mol |
| LogP | 3.3792 |
| Topological Polar Surface Area | 173.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.06586 |
| Heavy Atoms | 28 |
| Complexity | 1121.7687 |
Chemical Identifiers
| CAS Number | 330562-00-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)N=NC2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])O |
Product Overview
BAS 00494368 (CAS 330562-00-0), with molecular formula C16H11N5O7 and molecular weight 385.07 g/mol. IUPAC: N-[(2-hydroxy-5-nitro-1H-indol-3-yl)imino]-2-(2-nitrophenoxy)acetamide.
Chemical Property Profile of BAS 00494368
Property Insights of BAS 00494368
The XLogP value of 3.3792 indicates that BAS 00494368 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 173.32 Ų indicates high polarity, suggesting BAS 00494368 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00494368 has 2 hydrogen bond donor(s) and 8 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 00494368?
The CAS number of BAS 00494368 is 330562-00-0.
What is the molecular formula of BAS 00494368?
The molecular formula of BAS 00494368 is C16H11N5O7.
What is the molecular weight of BAS 00494368?
The molecular weight of BAS 00494368 is 385.07 g/mol.
Where can I buy BAS 00494368?
You can request a quote for BAS 00494368 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00494368?
Yes, KEHONG BIO provides custom synthesis services for BAS 00494368 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.