1-imino-5-phenyl-1H-isoindol-3-amine
TL;DR: 1-imino-5-phenyl-1H-isoindol-3-amine (CAS 32654-83-4) is a chemical compound with molecular formula C14H11N3 and molecular weight 221.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-imino-5-phenylisoindol-1-amine
Also Known As: 3-imino-5-phenylisoindol-1-amine, 3-Amino-1-imino-6-phenyl-1H-isoindole, 1-imino-5-phenyl-1H-isoindol-3-amine, 1-Imino-6-phenyl-1H-isoindole-3-amine, 3-Amino-1-imino-5-phenyl-1H-isoindole
| Molecular Formula | C14H11N3 |
|---|---|
| Molecular Weight | 221.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.09529 |
| Heavy Atoms | 17 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 32654-83-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=NC3=N)N |
| InChIKey | LXPAHWDZVJKVJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-imino-5-phenyl-1H-isoindol-3-amine (CAS 32654-83-4), with molecular formula C14H11N3 and molecular weight 221.10 g/mol. IUPAC: 3-imino-5-phenylisoindol-1-amine.
Chemical Property Profile of 1-imino-5-phenyl-1H-isoindol-3-amine
Property Insights of 1-imino-5-phenyl-1H-isoindol-3-amine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-imino-5-phenyl-1H-isoindol-3-amine. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-imino-5-phenyl-1H-isoindol-3-amine. Following Lipinski's Rule of Five, 1-imino-5-phenyl-1H-isoindol-3-amine has 2 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 1-imino-5-phenyl-1H-isoindol-3-amine?
The CAS number of 1-imino-5-phenyl-1H-isoindol-3-amine is 32654-83-4.
What is the molecular formula of 1-imino-5-phenyl-1H-isoindol-3-amine?
The molecular formula of 1-imino-5-phenyl-1H-isoindol-3-amine is C14H11N3.
What is the molecular weight of 1-imino-5-phenyl-1H-isoindol-3-amine?
The molecular weight of 1-imino-5-phenyl-1H-isoindol-3-amine is 221.10 g/mol.
Where can I buy 1-imino-5-phenyl-1H-isoindol-3-amine?
You can request a quote for 1-imino-5-phenyl-1H-isoindol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-imino-5-phenyl-1H-isoindol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-imino-5-phenyl-1H-isoindol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.