C25H17BrClNO3
TL;DR: C25H17BrClNO3 (CAS 139781-21-8) is a chemical compound with molecular formula C25H17BrClNO3 and molecular weight 493.00803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-4-(2-chlorophenyl)-3-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one
Also Known As: BAS 00163910, BIM-0005533.P001, (2E)-1-[6-bromo-4-(2-chlorophenyl)-2-hydroxyquinolin-3-yl]-3-(2-methoxyphenyl)prop-2-en-1-one, (E)-6-bromo-4-(2-chlorophenyl)-3-(3-(2-methoxyphenyl)acryloyl)quinolin-2(1H)-one, 3-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]-6-bromo-4-(2-chlorophenyl)hydroquinol in-2-one
Technical Specifications
| Molecular Formula | C25H17BrClNO3 |
| Molecular Weight | 493.00803 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 493.00803 Da |
| Heavy Atoms | 31 |
| Complexity | 751.0 |
| SMILES | COC1=CC=CC=C1/C=C/C(=O)C2=C(C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4Cl |
| InChIKey | BNQWQKANKHJUKT-JLHYYAGUSA-N |
Chemical Property Profile of C25H17BrClNO3
Property Insights of C25H17BrClNO3
The XLogP value of 5.8 indicates that C25H17BrClNO3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, C25H17BrClNO3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C25H17BrClNO3 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C25H17BrClNO3?
The CAS number of C25H17BrClNO3 is 139781-21-8.
What is the molecular formula of C25H17BrClNO3?
The molecular formula of C25H17BrClNO3 is C25H17BrClNO3.
What is the molecular weight of C25H17BrClNO3?
The molecular weight of C25H17BrClNO3 is 493.00803 g/mol.
Where can I buy C25H17BrClNO3?
You can request a quote for C25H17BrClNO3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C25H17BrClNO3?
Yes, CoreyChem provides custom synthesis services for C25H17BrClNO3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.