![[3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone structure](/static/products/4450/445018-12-2.webp)
[3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone
TL;DR: [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone (CAS 445018-12-2) is a chemical compound with molecular formula C21H23BrN4O and molecular weight 426.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3-bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone
Also Known As: [3-(3-bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone, 3-(3-bromo(1,2,4-triazolyl))adamantanyl indolinyl ketone, 1-{[3-(3-bromo-1H-1,2,4-triazol-1-yl)-1-adamantyl]carbonyl}indoline, [3-(3-bromo-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl](2,3-dihydro-1H-indol-1-yl)methanone
| Molecular Formula | C21H23BrN4O |
|---|---|
| Molecular Weight | 426.11 g/mol |
| LogP | 3.9254 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 426.10553 |
| Heavy Atoms | 27 |
| Complexity | 923.76776 |
Chemical Identifiers
| CAS Number | 445018-12-2 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)C34CC5CC(C3)CC(C5)(C4)N6C=NC(=N6)Br |
Product Overview
[3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone (CAS 445018-12-2), with molecular formula C21H23BrN4O and molecular weight 426.11 g/mol. IUPAC: [3-(3-bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone.
Chemical Property Profile of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone
Property Insights of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone
The XLogP value of 3.9254 indicates that [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.02 Ų, [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone 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 [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone?
The CAS number of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone is 445018-12-2.
What is the molecular formula of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone?
The molecular formula of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone is C21H23BrN4O.
What is the molecular weight of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone?
The molecular weight of [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone is 426.11 g/mol.
Where can I buy [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone?
You can request a quote for [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [3-(3-Bromo-1,2,4-triazol-1-yl)-1-adamantyl]-(2,3-dihydroindol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.