22-Azacholesterol
TL;DR: 22-Azacholesterol (CAS 40521-33-3) is a chemical compound with molecular formula C26H45NO and molecular weight 387.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(1S)-1-(3-methylbutylamino)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: 22-Azacholesterol, 22-NHC (inactive isomer), (20S)-22-Azacholesta-5-ene-3beta-ol, 20-[(3-Methylbutyl)amino]pregn-5-en-3-ol, J3.208.469I
| Molecular Formula | C26H45NO |
|---|---|
| Molecular Weight | 387.35 g/mol |
| LogP | 5.9505 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.35013 |
| Heavy Atoms | 28 |
| Complexity | 597.24023 |
Chemical Identifiers
| CAS Number | 40521-33-3 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)NCCC(C)C |
Product Overview
22-Azacholesterol (CAS 40521-33-3), with molecular formula C26H45NO and molecular weight 387.35 g/mol. IUPAC: (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(1S)-1-(3-methylbutylamino)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of 22-Azacholesterol
Property Insights of 22-Azacholesterol
The XLogP value of 5.9505 indicates that 22-Azacholesterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.26 Ų, 22-Azacholesterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 22-Azacholesterol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 22-Azacholesterol?
The CAS number of 22-Azacholesterol is 40521-33-3.
What is the molecular formula of 22-Azacholesterol?
The molecular formula of 22-Azacholesterol is C26H45NO.
What is the molecular weight of 22-Azacholesterol?
The molecular weight of 22-Azacholesterol is 387.35 g/mol.
Where can I buy 22-Azacholesterol?
You can request a quote for 22-Azacholesterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 22-Azacholesterol?
Yes, KEHONG BIO provides custom synthesis services for 22-Azacholesterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.