(5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone
TL;DR: (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone (CAS 898923-89-2) is a chemical compound with molecular formula C16H20BrN3O and molecular weight 349.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-1-yl)methanone
Also Known As: (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone, (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-1-yl)methanone
| Molecular Formula | C16H20BrN3O |
|---|---|
| Molecular Weight | 349.08 g/mol |
| LogP | 3.01652 |
| Topological Polar Surface Area | 39.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.07898 |
| Heavy Atoms | 21 |
| Complexity | 671.4571 |
Chemical Identifiers
| CAS Number | 898923-89-2 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)C2=C(C3=C(N2)C=CC(=C3)Br)C |
Product Overview
(5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone (CAS 898923-89-2), with molecular formula C16H20BrN3O and molecular weight 349.08 g/mol. IUPAC: (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-1-yl)methanone.
Chemical Property Profile of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone
Property Insights of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone
The XLogP value of 3.01652 indicates that (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.34 Ų, (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone has 1 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 (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone?
The CAS number of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone is 898923-89-2.
What is the molecular formula of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone?
The molecular formula of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone is C16H20BrN3O.
What is the molecular weight of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone?
The molecular weight of (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone is 349.08 g/mol.
Where can I buy (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone?
You can request a quote for (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-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 (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.