1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol
TL;DR: 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol (CAS 100009-99-2) is a chemical compound with molecular formula C21H25NO4 and molecular weight 355.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-3,6,7-trimethoxyphenanthren-4-ol
Also Known As: 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol, 1-[2-(dimethylamino)ethyl]-3,6,7-trimethoxyphenanthren-4-ol, 1-(2-dimethylaminoethyl)-3,6,7-trimethoxy-phenanthren-4-ol, RefChem:223416
| Molecular Formula | C21H25NO4 |
|---|---|
| Molecular Weight | 355.18 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.17834 |
| Heavy Atoms | 26 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 100009-99-2 |
|---|---|
| SMILES | CN(C)CCC1=CC(=C(C2=C1C=CC3=CC(=C(C=C32)OC)OC)O)OC |
| InChIKey | HVZVJBZDWBORKU-UHFFFAOYSA-N |
Product Overview
1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol (CAS 100009-99-2), with molecular formula C21H25NO4 and molecular weight 355.18 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-3,6,7-trimethoxyphenanthren-4-ol.
Chemical Property Profile of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol
Property Insights of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol
The XLogP value of 4.3 indicates that 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol has 1 hydrogen bond donor(s) and 5 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 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol?
The CAS number of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol is 100009-99-2.
What is the molecular formula of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol?
The molecular formula of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol is C21H25NO4.
What is the molecular weight of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol?
The molecular weight of 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol is 355.18 g/mol.
Where can I buy 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol?
You can request a quote for 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Dimethylaminoethyl)-3,6,7-trimethoxyphenanthren-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.