RefChem:401643
TL;DR: RefChem:401643 (CAS 606962-48-5) is a chemical compound with molecular formula C27H19FN4O3S and molecular weight 498.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-2-(4-ethoxyphenyl)-5-[1-[(2-fluorophenyl)methyl]-2-oxoindol-3-ylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (3Z)-3-(2-(4-ethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)-1-(2-fluorobenzyl)-1,3-dihydro-2H-indol-2-one, 3-[2-(4-ethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(2-fluorobenzyl)-1,3-dihydro-2H-indol-2-one, (5Z)-2-(4-ethoxyphenyl)-5-[1-[(2-fluorophenyl)methyl]-2-oxoindol-3-ylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, (3Z)-3-(2-(4-ETHOXYPHENYL)-6-OXO(1,3)THIAZOLO(3,2-B)(1,2,4)TRIAZOL-5(6H)-YLIDENE)-1-(2-FLUOROBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE, (3Z)-3-[2-(4-ethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(2-fluorobenzyl)-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C27H19FN4O3S |
|---|---|
| Molecular Weight | 498.12 g/mol |
| LogP | 3.8205 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 498.11618 |
| Heavy Atoms | 36 |
| Complexity | 1743.2524 |
Chemical Identifiers
| CAS Number | 606962-48-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=NN3C(=O)/C(=C/4\C5=CC=CC=C5N(C4=O)CC6=CC=CC=C6F)/SC3=N2 |
Product Overview
RefChem:401643 (CAS 606962-48-5), with molecular formula C27H19FN4O3S and molecular weight 498.12 g/mol. IUPAC: (5Z)-2-(4-ethoxyphenyl)-5-[1-[(2-fluorophenyl)methyl]-2-oxoindol-3-ylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of RefChem:401643
Property Insights of RefChem:401643
The XLogP value of 3.8205 indicates that RefChem:401643 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:401643. Following Lipinski's Rule of Five, RefChem:401643 has 0 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 RefChem:401643?
The CAS number of RefChem:401643 is 606962-48-5.
What is the molecular formula of RefChem:401643?
The molecular formula of RefChem:401643 is C27H19FN4O3S.
What is the molecular weight of RefChem:401643?
The molecular weight of RefChem:401643 is 498.12 g/mol.
Where can I buy RefChem:401643?
You can request a quote for RefChem:401643 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:401643?
Yes, KEHONG BIO provides custom synthesis services for RefChem:401643 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.