CAS 7062-07-9 - C21H14N2O3S
TL;DR: CAS 7062-07-9 - C21H14N2O3S (CAS 7062-07-9) is a chemical compound with molecular formula C21H14N2O3S and molecular weight 374.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-3-(1-oxo-3,4-dihydroisochromen-3-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
| Molecular Formula | C21H14N2O3S |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 4.38448 |
| Topological Polar Surface Area | 83.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.0725 |
| Heavy Atoms | 27 |
| Complexity | 1080.0612 |
Chemical Identifiers
| CAS Number | 7062-07-9 |
|---|---|
| SMILES | C1C(OC(=O)C2=CC=CC=C21)C(=C(C#N)C3=NC(=CS3)C4=CC=CC=C4)O |
Product Overview
CAS 7062-07-9 - C21H14N2O3S (CAS 7062-07-9), with molecular formula C21H14N2O3S and molecular weight 374.07 g/mol. IUPAC: 3-hydroxy-3-(1-oxo-3,4-dihydroisochromen-3-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of CAS 7062-07-9 - C21H14N2O3S
Property Insights of CAS 7062-07-9 - C21H14N2O3S
The XLogP value of 4.38448 indicates that CAS 7062-07-9 - C21H14N2O3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.21 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 7062-07-9 - C21H14N2O3S. Following Lipinski's Rule of Five, CAS 7062-07-9 - C21H14N2O3S 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 CAS 7062-07-9 - C21H14N2O3S?
The CAS number of CAS 7062-07-9 - C21H14N2O3S is 7062-07-9.
What is the molecular formula of CAS 7062-07-9 - C21H14N2O3S?
The molecular formula of CAS 7062-07-9 - C21H14N2O3S is C21H14N2O3S.
What is the molecular weight of CAS 7062-07-9 - C21H14N2O3S?
The molecular weight of CAS 7062-07-9 - C21H14N2O3S is 374.07 g/mol.
Where can I buy CAS 7062-07-9 - C21H14N2O3S?
You can request a quote for CAS 7062-07-9 - C21H14N2O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 7062-07-9 - C21H14N2O3S?
Yes, KEHONG BIO provides custom synthesis services for CAS 7062-07-9 - C21H14N2O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.