AB00102324-01
TL;DR: AB00102324-01 (CAS 332907-85-4) is a chemical compound with molecular formula C23H18N2O5S and molecular weight 434.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-hydroxy-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propoxy]phenyl]benzonitrile
Also Known As: AB00102324-01, 4-[4-[2-hydroxy-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propoxy]phenyl]benzonitrile, 4'-(3-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)-2-hydroxypropoxy)-[1,1'-biphenyl]-4-carbonitrile, 4'-[3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-2-hydroxypropoxy]biphenyl-4-carbonitrile
| Molecular Formula | C23H18N2O5S |
|---|---|
| Molecular Weight | 434.09 g/mol |
| LogP | 2.80968 |
| Topological Polar Surface Area | 107.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.09363 |
| Heavy Atoms | 31 |
| Complexity | 1262.569 |
Chemical Identifiers
| CAS Number | 332907-85-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC(COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)O |
Product Overview
AB00102324-01 (CAS 332907-85-4), with molecular formula C23H18N2O5S and molecular weight 434.09 g/mol. IUPAC: 4-[4-[2-hydroxy-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propoxy]phenyl]benzonitrile.
Chemical Property Profile of AB00102324-01
Property Insights of AB00102324-01
The XLogP value of 2.80968 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00102324-01. The TPSA of 107.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00102324-01. Following Lipinski's Rule of Five, AB00102324-01 has 1 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 AB00102324-01?
The CAS number of AB00102324-01 is 332907-85-4.
What is the molecular formula of AB00102324-01?
The molecular formula of AB00102324-01 is C23H18N2O5S.
What is the molecular weight of AB00102324-01?
The molecular weight of AB00102324-01 is 434.09 g/mol.
Where can I buy AB00102324-01?
You can request a quote for AB00102324-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00102324-01?
Yes, KEHONG BIO provides custom synthesis services for AB00102324-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.