![1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one structure](/static/products/1723/172372-05-3.webp)
1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
TL;DR: 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one (CAS 172372-05-3) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(benzyliminomethyl)-3-hydroxyindol-1-yl]ethanone
Also Known As: ChemDiv3_002914, 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one, AH-262/34227047, AB00086716-01, 1-[2-(benzyliminomethyl)-3-hydroxyindol-1-yl]ethanone
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 3.6261 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 848.1546 |
Chemical Identifiers
| CAS Number | 172372-05-3 |
|---|---|
| SMILES | CC(=O)N1C2=CC=CC=C2C(=C1C=NCC3=CC=CC=C3)O |
Product Overview
1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one (CAS 172372-05-3), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: 1-[2-(benzyliminomethyl)-3-hydroxyindol-1-yl]ethanone.
Chemical Property Profile of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
Property Insights of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
The XLogP value of 3.6261 indicates that 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-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 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The CAS number of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is 172372-05-3.
What is the molecular formula of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The molecular formula of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is C18H16N2O2.
What is the molecular weight of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The molecular weight of 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is 292.12 g/mol.
Where can I buy 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
You can request a quote for 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-acetyl-2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.