2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one
TL;DR: 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one (CAS 6311-42-8) is a chemical compound with molecular formula C24H25NO and molecular weight 343.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one
Also Known As: 2-benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one, 2-benzyl-1,3a,6-trimethyl-3-phenyl-1,3a,7,7a-tetrahydro-4h-indol-4-one, 4H-Indol-4-one,1,3a,7,7a-tetrahydro-1,3a,6-trimethyl-3-phenyl-2-(phenylmethyl)-
| Molecular Formula | C24H25NO |
|---|---|
| Molecular Weight | 343.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.1936 |
| Heavy Atoms | 26 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 6311-42-8 |
|---|---|
| SMILES | CC1=CC(=O)C2(C(C1)N(C(=C2C3=CC=CC=C3)CC4=CC=CC=C4)C)C |
| InChIKey | AYHWOFRGVYNNHK-UHFFFAOYSA-N |
Product Overview
2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one (CAS 6311-42-8), with molecular formula C24H25NO and molecular weight 343.19 g/mol. IUPAC: 2-benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one.
Chemical Property Profile of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one
Property Insights of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one
The XLogP value of 4.5 indicates that 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one has 0 hydrogen bond donor(s) and 2 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 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one?
The CAS number of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one is 6311-42-8.
What is the molecular formula of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one?
The molecular formula of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one is C24H25NO.
What is the molecular weight of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one?
The molecular weight of 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one is 343.19 g/mol.
Where can I buy 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one?
You can request a quote for 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-1,3a,6-trimethyl-3-phenyl-7,7a-dihydroindol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.