SB-431542
TL;DR: SB-431542 (CAS 301836-41-9) is a chemical compound with molecular formula C22H16N4O3 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
SB-431542
4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzamide
Also Known As: SB 431542, 4-(4-(benzo[d][1,3]dioxol-5-yl)-5-(pyridin-2-yl)-1H-imidazol-2-yl)benzamide, 3tzm, Compound 14, SB 431542 hydrate
| Molecular Formula | C22H16N4O3 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 3.6333 |
| Topological Polar Surface Area | 103.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.12225 |
| Heavy Atoms | 29 |
| Complexity | 1200.7218 |
Chemical Identifiers
| CAS Number | 301836-41-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=C(NC(=N3)C4=CC=C(C=C4)C(=O)N)C5=CC=CC=N5 |
Product Overview
SB-431542 (CAS 301836-41-9), with molecular formula C22H16N4O3 and molecular weight 384.12 g/mol. IUPAC: 4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzamide.
Chemical Property Profile of SB-431542
Property Insights of SB-431542
The XLogP value of 3.6333 indicates that Chemical Compound (C22H16N4O3) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.12 Ų falls within the moderate polarity range, balancing permeability and solubility for SB-431542. Following Lipinski's Rule of Five, Chemical Compound (C22H16N4O3) has 2 hydrogen bond donor(s) and 5 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 Chemical Compound (C22H16N4O3)?
The CAS number of Chemical Compound (C22H16N4O3) is 301836-41-9.
What is the molecular formula of Chemical Compound (C22H16N4O3)?
The molecular formula of Chemical Compound (C22H16N4O3) is C22H16N4O3.
What is the molecular weight of Chemical Compound (C22H16N4O3)?
The molecular weight of Chemical Compound (C22H16N4O3) is 384.12 g/mol.
Where can I buy Chemical Compound (C22H16N4O3)?
You can request a quote for Chemical Compound (C22H16N4O3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chemical Compound (C22H16N4O3)?
Yes, KEHONG BIO provides custom synthesis services for Chemical Compound (C22H16N4O3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.