ChemDiv1_010260
TL;DR: ChemDiv1_010260 (CAS 442555-27-3) is a chemical compound with molecular formula C19H14BrN3O3S and molecular weight 442.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5-bromo-2-oxoindol-3-yl)-4-(4-ethoxyanilino)-3H-1,3-thiazol-2-one
Also Known As: ChemDiv1_010260, (3E)-5-bromo-3-{(4Z)-4-[(4-ethoxyphenyl)imino]-2-oxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one, (4Z,5E)-5-(5-bromo-2-oxoindolin-3-ylidene)-4-((4-ethoxyphenyl)imino)thiazolidin-2-one, (5E)-5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-(4-ethoxyanilino)-1,3-thiazol-2-one, (5Z)-5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-(4-ethoxyanilino)-1,3-thiazol-2-one
| Molecular Formula | C19H14BrN3O3S |
|---|---|
| Molecular Weight | 442.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 83.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.99393 |
| Heavy Atoms | 27 |
| Complexity | 1212.2323 |
Chemical Identifiers
| CAS Number | 442555-27-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=C(SC(=O)N2)C3=C4C=C(C=CC4=NC3=O)Br |
Product Overview
ChemDiv1_010260 (CAS 442555-27-3), with molecular formula C19H14BrN3O3S and molecular weight 442.99 g/mol. IUPAC: 5-(5-bromo-2-oxoindol-3-yl)-4-(4-ethoxyanilino)-3H-1,3-thiazol-2-one.
Chemical Property Profile of ChemDiv1_010260
Property Insights of ChemDiv1_010260
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_010260. The TPSA of 83.55 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010260. Following Lipinski's Rule of Five, ChemDiv1_010260 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 ChemDiv1_010260?
The CAS number of ChemDiv1_010260 is 442555-27-3.
What is the molecular formula of ChemDiv1_010260?
The molecular formula of ChemDiv1_010260 is C19H14BrN3O3S.
What is the molecular weight of ChemDiv1_010260?
The molecular weight of ChemDiv1_010260 is 442.99 g/mol.
Where can I buy ChemDiv1_010260?
You can request a quote for ChemDiv1_010260 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010260?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010260 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.