benzylideneisoindolin-3-one
TL;DR: benzylideneisoindolin-3-one (CAS 33608-93-4) is a chemical compound with molecular formula C15H11NO and molecular weight 221.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylideneisoindol-1-one
Also Known As: benzylideneisoindolin-3-one, 3-benzylideneisoindol-1-one, 3-benzylidenenaphthalimide, 3-Benzylidene-2,3-dihydro-1H-isoindol-1-one, 1H-Isoindol-1-one, 2,3-dihydro-3-(phenylmethylene)-, (E)-
| Molecular Formula | C15H11NO |
|---|---|
| Molecular Weight | 221.08 g/mol |
| LogP | 2.9281 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.08406 |
| Heavy Atoms | 17 |
| Complexity | 599.3287 |
Chemical Identifiers
| CAS Number | 33608-93-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C3=CC=CC=C3C(=O)N2 |
Product Overview
benzylideneisoindolin-3-one (CAS 33608-93-4), with molecular formula C15H11NO and molecular weight 221.08 g/mol. IUPAC: 3-benzylideneisoindol-1-one.
Chemical Property Profile of benzylideneisoindolin-3-one
Property Insights of benzylideneisoindolin-3-one
The XLogP value of 2.9281 suggests moderate lipophilicity, balancing water solubility and membrane permeability for benzylideneisoindolin-3-one. With a topological polar surface area (TPSA) of 29.1 Ų, benzylideneisoindolin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, benzylideneisoindolin-3-one has 1 hydrogen bond donor(s) and 1 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 benzylideneisoindolin-3-one?
The CAS number of benzylideneisoindolin-3-one is 33608-93-4.
What is the molecular formula of benzylideneisoindolin-3-one?
The molecular formula of benzylideneisoindolin-3-one is C15H11NO.
What is the molecular weight of benzylideneisoindolin-3-one?
The molecular weight of benzylideneisoindolin-3-one is 221.08 g/mol.
Where can I buy benzylideneisoindolin-3-one?
You can request a quote for benzylideneisoindolin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzylideneisoindolin-3-one?
Yes, KEHONG BIO provides custom synthesis services for benzylideneisoindolin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.