4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one
TL;DR: 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one (CAS 53207-57-1) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1,3,3-trimethyl-4H-quinolin-2-one
Also Known As: 4-hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1h)-one, 4-hydroxy-1,3,3-trimethyl-4H-quinolin-2-one, 5-21-12-00253 (Beilstein Handbook Reference), 1,3,3-Trimethyl-1,2,3,4-tetrahydro-4-quinolinol-2-one, 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-1,3,3-trimethyl-
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 53207-57-1 |
|---|---|
| SMILES | CC1(C(C2=CC=CC=C2N(C1=O)C)O)C |
| InChIKey | BXZGPXNHCITSAH-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one (CAS 53207-57-1), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 4-hydroxy-1,3,3-trimethyl-4H-quinolin-2-one.
Chemical Property Profile of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one
Property Insights of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one. With a topological polar surface area (TPSA) of 40.5 Ų, 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one has 1 hydrogen bond donor(s) and 2 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 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one?
The CAS number of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one is 53207-57-1.
What is the molecular formula of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one?
The molecular formula of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one is C12H15NO2.
What is the molecular weight of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one?
The molecular weight of 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one is 205.11 g/mol.
Where can I buy 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one?
You can request a quote for 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-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 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-1,3,3-trimethyl-3,4-dihydroquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.