3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene
TL;DR: 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene (CAS 131589-60-1) is a chemical compound with molecular formula C21H13N3O3S and molecular weight 387.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-azidophenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone
Also Known As: Protioaryl azide, paa, Protioaryl azide,paa, 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene, SID:134222278, (4-Azidophenyl)(6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thien-3-yl)methanone
| Molecular Formula | C21H13N3O3S |
|---|---|
| Molecular Weight | 387.07 g/mol |
| LogP | 6.1523 |
| Topological Polar Surface Area | 106.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.06775 |
| Heavy Atoms | 28 |
| Complexity | 1238.6273 |
Chemical Identifiers
| CAS Number | 131589-60-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)N=[N+]=[N-])O |
Product Overview
3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene (CAS 131589-60-1), with molecular formula C21H13N3O3S and molecular weight 387.07 g/mol. IUPAC: (4-azidophenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone.
Chemical Property Profile of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene
Property Insights of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene
The XLogP value of 6.1523 indicates that 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene. Following Lipinski's Rule of Five, 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene?
The CAS number of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene is 131589-60-1.
What is the molecular formula of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene?
The molecular formula of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene is C21H13N3O3S.
What is the molecular weight of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene?
The molecular weight of 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene is 387.07 g/mol.
Where can I buy 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene?
You can request a quote for 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Azidobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.