(3S)-3-hydroxy-1-methyl-3H-indol-2-one
TL;DR: (3S)-3-hydroxy-1-methyl-3H-indol-2-one (CAS 1126736-27-3) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-hydroxy-1-methyl-3H-indol-2-one
Also Known As: 1-Methyl-3beta-hydroxyindoline-2-one, (3S)-3-hydroxy-1-methyl-3H-indol-2-one, J2.710.878D, (3s)-1,3-dihydro-3-hydroxy-1-methyl-2h-indol-2-one, (3S)-3-hydroxy-1-methyl-2,3-dihydro-1H-indol-2-one
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 0.6964 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 304.05536 |
Chemical Identifiers
| CAS Number | 1126736-27-3 |
|---|---|
| SMILES | CN1C2=CC=CC=C2[C@@H](C1=O)O |
Product Overview
(3S)-3-hydroxy-1-methyl-3H-indol-2-one (CAS 1126736-27-3), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: (3S)-3-hydroxy-1-methyl-3H-indol-2-one.
Chemical Property Profile of (3S)-3-hydroxy-1-methyl-3H-indol-2-one
Property Insights of (3S)-3-hydroxy-1-methyl-3H-indol-2-one
The XLogP value of 0.6964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-hydroxy-1-methyl-3H-indol-2-one. With a topological polar surface area (TPSA) of 40.54 Ų, (3S)-3-hydroxy-1-methyl-3H-indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-3-hydroxy-1-methyl-3H-indol-2-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 (3S)-3-hydroxy-1-methyl-3H-indol-2-one?
The CAS number of (3S)-3-hydroxy-1-methyl-3H-indol-2-one is 1126736-27-3.
What is the molecular formula of (3S)-3-hydroxy-1-methyl-3H-indol-2-one?
The molecular formula of (3S)-3-hydroxy-1-methyl-3H-indol-2-one is C9H9NO2.
What is the molecular weight of (3S)-3-hydroxy-1-methyl-3H-indol-2-one?
The molecular weight of (3S)-3-hydroxy-1-methyl-3H-indol-2-one is 163.06 g/mol.
Where can I buy (3S)-3-hydroxy-1-methyl-3H-indol-2-one?
You can request a quote for (3S)-3-hydroxy-1-methyl-3H-indol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-3-hydroxy-1-methyl-3H-indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-hydroxy-1-methyl-3H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.