21-F-R 5020
TL;DR: 21-F-R 5020 (CAS 128857-34-1) is a chemical compound with molecular formula C19H31Cl2N3O and molecular weight 387.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(tert-butylamino)-3-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)propan-2-ol;dihydrochloride
Also Known As: 21-F-R 5020, 2H-Pyrido(3,4-b)indole-2-ethanol, 1,3,4,9-tetrahydro-alpha-(((1,1-dimethylethyl)amino)methyl-1-methyl-, dihydrochloride, 1-(tert-butylamino)-3-(1-methyl-1,3,4,9-tetrahydropyrido[3,4, 1-(tert-butylamino)-3-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)propan-2-ol;dihydrochloride, 2H-Pyrido(3,4-b)indole-2-ethanol, 1,3,4,9-tetrahydro-alpha-(((1,1-dime thylethyl)amino)methyl-1-meth
| Molecular Formula | C19H31Cl2N3O |
|---|---|
| Molecular Weight | 387.18 g/mol |
| LogP | 3.6796 |
| Topological Polar Surface Area | 51.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.18442 |
| Heavy Atoms | 25 |
| Complexity | 680.8493 |
Chemical Identifiers
| CAS Number | 128857-34-1 |
|---|---|
| SMILES | CC1C2=C(CCN1CC(CNC(C)(C)C)O)C3=CC=CC=C3N2.Cl.Cl |
Product Overview
21-F-R 5020 (CAS 128857-34-1), with molecular formula C19H31Cl2N3O and molecular weight 387.18 g/mol. IUPAC: 1-(tert-butylamino)-3-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)propan-2-ol;dihydrochloride.
Chemical Property Profile of 21-F-R 5020
Property Insights of 21-F-R 5020
The XLogP value of 3.6796 indicates that 21-F-R 5020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.29 Ų, 21-F-R 5020 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 21-F-R 5020 has 3 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 21-F-R 5020?
The CAS number of 21-F-R 5020 is 128857-34-1.
What is the molecular formula of 21-F-R 5020?
The molecular formula of 21-F-R 5020 is C19H31Cl2N3O.
What is the molecular weight of 21-F-R 5020?
The molecular weight of 21-F-R 5020 is 387.18 g/mol.
Where can I buy 21-F-R 5020?
You can request a quote for 21-F-R 5020 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 21-F-R 5020?
Yes, KEHONG BIO provides custom synthesis services for 21-F-R 5020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.