N-Phenylphthalisoimide
TL;DR: N-Phenylphthalisoimide (CAS 487-42-3) is a chemical compound with molecular formula C14H9NO2 and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylimino-2-benzofuran-1-one
Also Known As: ISOPHTHALANIL, N-Phenylphthalisoimide, 3-phenylimino-2-benzofuran-1-one, 3-(Phenylimino)isobenzofuran-1(3H)-one, IDI1_008022
| Molecular Formula | C14H9NO2 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.06332 |
| Heavy Atoms | 17 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 487-42-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=C2C3=CC=CC=C3C(=O)O2 |
| InChIKey | KXKGLFXLEGRDNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Phenylphthalisoimide (CAS 487-42-3), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 3-phenylimino-2-benzofuran-1-one.
Chemical Property Profile of N-Phenylphthalisoimide
Property Insights of N-Phenylphthalisoimide
The XLogP value of 3.1 indicates that N-Phenylphthalisoimide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, N-Phenylphthalisoimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Phenylphthalisoimide has 0 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 N-Phenylphthalisoimide?
The CAS number of N-Phenylphthalisoimide is 487-42-3.
What is the molecular formula of N-Phenylphthalisoimide?
The molecular formula of N-Phenylphthalisoimide is C14H9NO2.
What is the molecular weight of N-Phenylphthalisoimide?
The molecular weight of N-Phenylphthalisoimide is 223.06 g/mol.
Where can I buy N-Phenylphthalisoimide?
You can request a quote for N-Phenylphthalisoimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phenylphthalisoimide?
Yes, KEHONG BIO provides custom synthesis services for N-Phenylphthalisoimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.