1H-isoindol-3-amine
TL;DR: 1H-isoindol-3-amine (CAS 76644-74-1) is a chemical compound with molecular formula C8H8N2 and molecular weight 132.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3H-isoindol-1-amine
Also Known As: 3-Amino-1H-isoindole, 1H-isoindol-3-amine, 3H-isoindol-1-amine, iminoisoindoline, Isoindolin-1-imine
| Molecular Formula | C8H8N2 |
|---|---|
| Molecular Weight | 132.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 132.06874 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 76644-74-1 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=N1)N |
| InChIKey | MTKKGHVQPVOXIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-isoindol-3-amine (CAS 76644-74-1), with molecular formula C8H8N2 and molecular weight 132.07 g/mol. IUPAC: 3H-isoindol-1-amine.
Chemical Property Profile of 1H-isoindol-3-amine
Property Insights of 1H-isoindol-3-amine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-isoindol-3-amine. With a topological polar surface area (TPSA) of 38.4 Ų, 1H-isoindol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-isoindol-3-amine 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 1H-isoindol-3-amine?
The CAS number of 1H-isoindol-3-amine is 76644-74-1.
What is the molecular formula of 1H-isoindol-3-amine?
The molecular formula of 1H-isoindol-3-amine is C8H8N2.
What is the molecular weight of 1H-isoindol-3-amine?
The molecular weight of 1H-isoindol-3-amine is 132.07 g/mol.
Where can I buy 1H-isoindol-3-amine?
You can request a quote for 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 1H-isoindol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1H-isoindol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.