BAS 00333171
TL;DR: BAS 00333171 (CAS 480994-96-5) is a chemical compound with molecular formula C36H24N4O4 and molecular weight 576.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dioxo-N-[4-(3-oxo-3-phenylprop-1-enyl)phenyl]-2-(4-phenyldiazenylphenyl)isoindole-5-carboxamide
Also Known As: BAS 00333171, 1H-Isoindole-5-carboxamide, 2,3-dihydro-1,3-dioxo-N-[4-(3-oxo-3-phenyl-1-propen-1-yl)phenyl]-2-[4-(2-phenyldiazenyl)phenyl]-, 1,3-dioxo-N-[4-(3-oxo-3-phenylprop-1-enyl)phenyl]-2-(4-phenyldiazenylphenyl)isoindole-5-carboxamide
| Molecular Formula | C36H24N4O4 |
|---|---|
| Molecular Weight | 576.18 g/mol |
| LogP | 8.051 |
| Topological Polar Surface Area | 108.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 576.17975 |
| Heavy Atoms | 44 |
| Complexity | 1932.8856 |
Chemical Identifiers
| CAS Number | 480994-96-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)N=NC6=CC=CC=C6 |
Product Overview
BAS 00333171 (CAS 480994-96-5), with molecular formula C36H24N4O4 and molecular weight 576.18 g/mol. IUPAC: 1,3-dioxo-N-[4-(3-oxo-3-phenylprop-1-enyl)phenyl]-2-(4-phenyldiazenylphenyl)isoindole-5-carboxamide.
Chemical Property Profile of BAS 00333171
Property Insights of BAS 00333171
The XLogP value of 8.051 indicates that BAS 00333171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00333171. Following Lipinski's Rule of Five, BAS 00333171 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00333171?
The CAS number of BAS 00333171 is 480994-96-5.
What is the molecular formula of BAS 00333171?
The molecular formula of BAS 00333171 is C36H24N4O4.
What is the molecular weight of BAS 00333171?
The molecular weight of BAS 00333171 is 576.18 g/mol.
Where can I buy BAS 00333171?
You can request a quote for BAS 00333171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00333171?
Yes, KEHONG BIO provides custom synthesis services for BAS 00333171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.