3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide
TL;DR: 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide (CAS 41958-81-0) is a chemical compound with molecular formula C18H20BrNO2 and molecular weight 361.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(dimethylamino)ethyl]phenanthrene-3,4-diol;hydrobromide
Also Known As: 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide, 8-(2-(Dimethylamino)ethyl)-3,4-phenanthrenediol hydrobromide, 1-(2-Dimethylaminoethyl)-5,6-dihydroxyphenanthrene hydrobromide, 8-(2-dimethylaminoethyl)phenanthrene-3,4-diol hydrobromide, 8-[2-(dimethylamino)ethyl]phenanthrene-3,4-diol,hydrobromide
| Molecular Formula | C18H20BrNO2 |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 4.0862 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.06775 |
| Heavy Atoms | 22 |
| Complexity | 814.89594 |
Chemical Identifiers
| CAS Number | 41958-81-0 |
|---|---|
| SMILES | CN(C)CCC1=C2C=CC3=C(C2=CC=C1)C(=C(C=C3)O)O.Br |
Product Overview
3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide (CAS 41958-81-0), with molecular formula C18H20BrNO2 and molecular weight 361.07 g/mol. IUPAC: 8-[2-(dimethylamino)ethyl]phenanthrene-3,4-diol;hydrobromide.
Chemical Property Profile of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide
Property Insights of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide
The XLogP value of 4.0862 indicates that 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide has 2 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 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide?
The CAS number of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide is 41958-81-0.
What is the molecular formula of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide?
The molecular formula of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide is C18H20BrNO2.
What is the molecular weight of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide?
The molecular weight of 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide is 361.07 g/mol.
Where can I buy 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide?
You can request a quote for 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Phenanthrenediol, 8-(2-(dimethylamino)ethyl)-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.