BIM-0028091.P001
TL;DR: BIM-0028091.P001 (CAS 294638-35-0) is a chemical compound with molecular formula C24H36N4O3 and molecular weight 428.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-[1-(1-adamantyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]ethanol
Also Known As: BIM-0028091.P001, A1533/0066655, 2-{4-[4-nitro-3-({1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}amino)phenyl]piperazin-1-yl}ethanol, 2-[4-[3-[1-(1-adamantyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]ethanol, 2-(4-(3-((1-((3r,5r,7r)-adamantan-1-yl)ethyl)amino)-4-nitrophenyl)piperazin-1-yl)ethanol
| Molecular Formula | C24H36N4O3 |
|---|---|
| Molecular Weight | 428.28 g/mol |
| LogP | 3.7259 |
| Topological Polar Surface Area | 81.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.27875 |
| Heavy Atoms | 31 |
| Complexity | 785.75824 |
Chemical Identifiers
| CAS Number | 294638-35-0 |
|---|---|
| SMILES | CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCN(CC5)CCO)[N+](=O)[O-] |
Product Overview
BIM-0028091.P001 (CAS 294638-35-0), with molecular formula C24H36N4O3 and molecular weight 428.28 g/mol. IUPAC: 2-[4-[3-[1-(1-adamantyl)ethylamino]-4-nitrophenyl]piperazin-1-yl]ethanol.
Chemical Property Profile of BIM-0028091.P001
Property Insights of BIM-0028091.P001
The XLogP value of 3.7259 indicates that BIM-0028091.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.88 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0028091.P001. Following Lipinski's Rule of Five, BIM-0028091.P001 has 2 hydrogen bond donor(s) and 6 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 BIM-0028091.P001?
The CAS number of BIM-0028091.P001 is 294638-35-0.
What is the molecular formula of BIM-0028091.P001?
The molecular formula of BIM-0028091.P001 is C24H36N4O3.
What is the molecular weight of BIM-0028091.P001?
The molecular weight of BIM-0028091.P001 is 428.28 g/mol.
Where can I buy BIM-0028091.P001?
You can request a quote for BIM-0028091.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0028091.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0028091.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.