3-(Bromomethyl)quinolin-2(1H)-one
TL;DR: 3-(Bromomethyl)quinolin-2(1H)-one (CAS 35740-85-3) is a chemical compound with molecular formula C10H8BrNO and molecular weight 236.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(bromomethyl)-1H-quinolin-2-one
Also Known As: (bromomethyl)quinolone, bromomethyl carbostyril, 3-bromomethylcarbostyril, 3-(bromomethyl)-1H-quinolin-2-one, 3-(Bromomethyl)quinolin-2(1H)-one
| Molecular Formula | C10H8BrNO |
|---|---|
| Molecular Weight | 236.98 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.97893 |
| Heavy Atoms | 13 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 35740-85-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)N2)CBr |
| InChIKey | LSAQTAKXZBLFIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Bromomethyl)quinolin-2(1H)-one (CAS 35740-85-3), with molecular formula C10H8BrNO and molecular weight 236.98 g/mol. IUPAC: 3-(bromomethyl)-1H-quinolin-2-one.
Chemical Property Profile of 3-(Bromomethyl)quinolin-2(1H)-one
Property Insights of 3-(Bromomethyl)quinolin-2(1H)-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Bromomethyl)quinolin-2(1H)-one. With a topological polar surface area (TPSA) of 29.1 Ų, 3-(Bromomethyl)quinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Bromomethyl)quinolin-2(1H)-one has 1 hydrogen bond donor(s) and 1 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 3-(Bromomethyl)quinolin-2(1H)-one?
The CAS number of 3-(Bromomethyl)quinolin-2(1H)-one is 35740-85-3.
What is the molecular formula of 3-(Bromomethyl)quinolin-2(1H)-one?
The molecular formula of 3-(Bromomethyl)quinolin-2(1H)-one is C10H8BrNO.
What is the molecular weight of 3-(Bromomethyl)quinolin-2(1H)-one?
The molecular weight of 3-(Bromomethyl)quinolin-2(1H)-one is 236.98 g/mol.
Where can I buy 3-(Bromomethyl)quinolin-2(1H)-one?
You can request a quote for 3-(Bromomethyl)quinolin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Bromomethyl)quinolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(Bromomethyl)quinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.