A2255/0095018
TL;DR: A2255/0095018 (CAS 330952-49-3) is a chemical compound with molecular formula C24H27BrN2O3 and molecular weight 470.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-5-hydroxy-2-[(4-methylpiperidin-1-yl)methyl]-1-phenylindole-3-carboxylate
Also Known As: A2255/0095018, BRD-K81246897-001-01-0, ethyl 6-bromo-5-hydroxy-2-[(4-methylpiperidin-1-yl)methyl]-1-phenyl-1H-indole-3-carboxylate, ethyl 6-bromo-5-hydroxy-2-[(4-methylpiperidin-1-yl)methyl]-1-phenylindole-3-carboxylate, ethyl 6-bromo-5-hydroxy-2-((4-methylpiperidin-1-yl)methyl)-1-phenyl-1H-indole-3-carboxylate
| Molecular Formula | C24H27BrN2O3 |
|---|---|
| Molecular Weight | 470.12 g/mol |
| LogP | 5.5072 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.1205 |
| Heavy Atoms | 30 |
| Complexity | 1053.4934 |
Chemical Identifiers
| CAS Number | 330952-49-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C3=CC=CC=C3)CN4CCC(CC4)C |
Product Overview
A2255/0095018 (CAS 330952-49-3), with molecular formula C24H27BrN2O3 and molecular weight 470.12 g/mol. IUPAC: ethyl 6-bromo-5-hydroxy-2-[(4-methylpiperidin-1-yl)methyl]-1-phenylindole-3-carboxylate.
Chemical Property Profile of A2255/0095018
Property Insights of A2255/0095018
The XLogP value of 5.5072 indicates that A2255/0095018 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, A2255/0095018 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2255/0095018 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2255/0095018?
The CAS number of A2255/0095018 is 330952-49-3.
What is the molecular formula of A2255/0095018?
The molecular formula of A2255/0095018 is C24H27BrN2O3.
What is the molecular weight of A2255/0095018?
The molecular weight of A2255/0095018 is 470.12 g/mol.
Where can I buy A2255/0095018?
You can request a quote for A2255/0095018 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2255/0095018?
Yes, KEHONG BIO provides custom synthesis services for A2255/0095018 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.