1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione
TL;DR: 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione (CAS 4058-46-2) is a chemical compound with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-oxo-1,2-dihydroindol-2-yl)-1,2-dihydroindol-3-one
Also Known As: 2,2'-Dihydroindigo, Leucoindigo, Dihydro-indigo, DIHYDROINDIGO, (2,2'-Biindoline)-3,3'-dione
| Molecular Formula | C16H12N2O2 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.08987 |
| Heavy Atoms | 20 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 4058-46-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(N2)C3C(=O)C4=CC=CC=C4N3 |
| InChIKey | JOTRJOWDDJFASP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione (CAS 4058-46-2), with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol. IUPAC: 2-(3-oxo-1,2-dihydroindol-2-yl)-1,2-dihydroindol-3-one.
Chemical Property Profile of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione
Property Insights of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione has 2 hydrogen bond donor(s) and 4 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 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione?
The CAS number of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione is 4058-46-2.
What is the molecular formula of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione?
The molecular formula of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione is C16H12N2O2.
What is the molecular weight of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione?
The molecular weight of 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione is 264.09 g/mol.
Where can I buy 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione?
You can request a quote for 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,1',2,2'-Tetrahydro(2,2'-bi-3H-indole)-3,3'-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.