Desmethylselegiline
TL;DR: Desmethylselegiline (CAS 18913-84-3) is a chemical compound with molecular formula C12H15N and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-phenyl-N-prop-2-ynylpropan-2-amine
Also Known As: Desmethylselegiline, Norselegiline, L-Nordeprenyl, Desmethyldeprenyl, L-Desmethyldeprenyl
| Molecular Formula | C12H15N |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.12045 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 18913-84-3 |
|---|---|
| SMILES | C[C@H](CC1=CC=CC=C1)NCC#C |
| InChIKey | UUFAJPMQSFXDFR-LLVKDONJSA-N |
Product Overview
Desmethylselegiline (CAS 18913-84-3), with molecular formula C12H15N and molecular weight 173.12 g/mol. IUPAC: (2R)-1-phenyl-N-prop-2-ynylpropan-2-amine.
Chemical Property Profile of Desmethylselegiline
Property Insights of Desmethylselegiline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desmethylselegiline. With a topological polar surface area (TPSA) of 12.0 Ų, Desmethylselegiline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Desmethylselegiline has 1 hydrogen bond donor(s) and 1 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 Desmethylselegiline?
The CAS number of Desmethylselegiline is 18913-84-3.
What is the molecular formula of Desmethylselegiline?
The molecular formula of Desmethylselegiline is C12H15N.
What is the molecular weight of Desmethylselegiline?
The molecular weight of Desmethylselegiline is 173.12 g/mol.
Where can I buy Desmethylselegiline?
You can request a quote for Desmethylselegiline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desmethylselegiline?
Yes, KEHONG BIO provides custom synthesis services for Desmethylselegiline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.