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2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
TL;DR: 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one (CAS 172372-04-2) is a chemical compound with molecular formula C16H14N2O and molecular weight 250.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzyliminomethyl)-1H-indol-3-ol
Also Known As: 2-benzylaminomethylene-3-indolinone, 2-(benzyliminomethyl)-1H-indol-3-ol, 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one, 2-[(benzylamino)methylidene]-1H-indol-3-one, AH-262/08373038
| Molecular Formula | C16H14N2O |
|---|---|
| Molecular Weight | 250.11 g/mol |
| LogP | 3.4926 |
| Topological Polar Surface Area | 48.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.11061 |
| Heavy Atoms | 19 |
| Complexity | 713.95197 |
Chemical Identifiers
| CAS Number | 172372-04-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN=CC2=C(C3=CC=CC=C3N2)O |
Product Overview
2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one (CAS 172372-04-2), with molecular formula C16H14N2O and molecular weight 250.11 g/mol. IUPAC: 2-(benzyliminomethyl)-1H-indol-3-ol.
Chemical Property Profile of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
Property Insights of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one
The XLogP value of 3.4926 indicates that 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 48.38 Ų, 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, 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one has 2 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 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The CAS number of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is 172372-04-2.
What is the molecular formula of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The molecular formula of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is C16H14N2O.
What is the molecular weight of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
The molecular weight of 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one is 250.11 g/mol.
Where can I buy 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
You can request a quote for 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 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(benzylamino)methylene]-1,2-dihydro-3H-indol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.