J3.331.119B
TL;DR: J3.331.119B (CAS 1609386-02-8) is a chemical compound with molecular formula C18H14BrNO3 and molecular weight 371.01572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-3-hydroxy-3-[(E)-2-oxo-4-phenylbut-3-enyl]-1H-indol-2-one
Also Known As: J3.331.119B, 5-bromo-3-hydroxy-3-[(3E)-2-oxo-4-phenylbut-3-en-1-yl]-1,3-dihydro-2H-indol-2-one, (E)-5-bromo-3-hydroxy-3-(2-oxo-4-phenylbut-3-en-1-yl)indolin-2-one, 5-bromo-3-hydroxy-3-[(E)-2-oxo-4-phenylbut-3-enyl]-1H-indol-2-one, 5-Bromo-3-hydroxy-3-[(E)-4-phenyl-2-oxo-3-butenyl]-1H-indole-2(3H)-one
Technical Specifications
| Molecular Formula | C18H14BrNO3 |
| Molecular Weight | 371.01572 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.01572 Da |
| Heavy Atoms | 23 |
| Complexity | 500.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)CC2(C3=C(C=CC(=C3)Br)NC2=O)O |
| InChIKey | UTPAHIYYZUPGHZ-SOFGYWHQSA-N |
Chemical Property Profile of J3.331.119B
Property Insights of J3.331.119B
The XLogP value of 3.0 indicates that J3.331.119B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.331.119B. Following Lipinski's Rule of Five, J3.331.119B has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of J3.331.119B?
The CAS number of J3.331.119B is 1609386-02-8.
What is the molecular formula of J3.331.119B?
The molecular formula of J3.331.119B is C18H14BrNO3.
What is the molecular weight of J3.331.119B?
The molecular weight of J3.331.119B is 371.01572 g/mol.
Where can I buy J3.331.119B?
You can request a quote for J3.331.119B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for J3.331.119B?
Yes, CoreyChem provides custom synthesis services for J3.331.119B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.