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3-[Hydroxy(methyl)amino]indol-2-one
TL;DR: 3-[Hydroxy(methyl)amino]indol-2-one (CAS 58418-20-5) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[hydroxy(methyl)amino]indol-2-one
Also Known As: 3-[hydroxy(methyl)amino]indol-2-one, 3-[Hydroxy(methyl)amino]-2H-indol-2-one, (E)-3-(N-oxide-methylimino)indolin-2-one, C~9~H~8~N~2~O~2~
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 58418-20-5 |
|---|---|
| SMILES | CN(C1=C2C=CC=CC2=NC1=O)O |
| InChIKey | VAAOFQNZVJUNPS-UHFFFAOYSA-N |
Product Overview
3-[Hydroxy(methyl)amino]indol-2-one (CAS 58418-20-5), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 3-[hydroxy(methyl)amino]indol-2-one.
Chemical Property Profile of 3-[Hydroxy(methyl)amino]indol-2-one
Property Insights of 3-[Hydroxy(methyl)amino]indol-2-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[Hydroxy(methyl)amino]indol-2-one. With a topological polar surface area (TPSA) of 52.9 Ų, 3-[Hydroxy(methyl)amino]indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[Hydroxy(methyl)amino]indol-2-one has 1 hydrogen bond donor(s) and 3 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-[Hydroxy(methyl)amino]indol-2-one?
The CAS number of 3-[Hydroxy(methyl)amino]indol-2-one is 58418-20-5.
What is the molecular formula of 3-[Hydroxy(methyl)amino]indol-2-one?
The molecular formula of 3-[Hydroxy(methyl)amino]indol-2-one is C9H8N2O2.
What is the molecular weight of 3-[Hydroxy(methyl)amino]indol-2-one?
The molecular weight of 3-[Hydroxy(methyl)amino]indol-2-one is 176.06 g/mol.
Where can I buy 3-[Hydroxy(methyl)amino]indol-2-one?
You can request a quote for 3-[Hydroxy(methyl)amino]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 3-[Hydroxy(methyl)amino]indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[Hydroxy(methyl)amino]indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.