Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-
TL;DR: Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- (CAS 522-71-4) is a chemical compound with molecular formula C20H25ClN2O and molecular weight 344.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,15R,18S,19R,20S)-19-(chloromethyl)-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-18-ol
Also Known As: 16-alpha-Chloromethylyohimbol, Yohimban-17-alpha-ol, 16-alpha-chloromethyl-, 16alpha-Chloromethylyohimban-17alpha-ol, 16alpha-(Chloromethyl)yohimban-17alpha-ol, ioxonan-3-yl)-3-formamidosalicylamide,stereoisomer
| Molecular Formula | C20H25ClN2O |
|---|---|
| Molecular Weight | 344.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 39.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.16553 |
| Heavy Atoms | 24 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 522-71-4 |
|---|---|
| SMILES | C1C[C@@H]([C@@H]([C@@H]2[C@@H]1CN3CCC4=C([C@@H]3C2)NC5=CC=CC=C45)CCl)O |
| InChIKey | GZFASIBQMJFPJC-DKWZOFSHSA-N |
Product Overview
Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- (CAS 522-71-4), with molecular formula C20H25ClN2O and molecular weight 344.17 g/mol. IUPAC: (1S,15R,18S,19R,20S)-19-(chloromethyl)-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-18-ol.
Chemical Property Profile of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-
Property Insights of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-
The XLogP value of 3.4 indicates that Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.3 Ų, Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- has 2 hydrogen bond donor(s) and 2 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 Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-?
The CAS number of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- is 522-71-4.
What is the molecular formula of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-?
The molecular formula of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- is C20H25ClN2O.
What is the molecular weight of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-?
The molecular weight of Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- is 344.17 g/mol.
Where can I buy Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-?
You can request a quote for Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Yohimban-17-ol, 16-(chloromethyl)-, (16alpha,17alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.