Axillaridine A
TL;DR: Axillaridine A (CAS 128255-16-3) is a chemical compound with molecular formula C30H42N2O2 and molecular weight 462.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]benzamide
Also Known As: Axillaridine A, Benzamide, N-[(5a,20S)-20-(dimethylamino)-4-oxopregn-2-en-3-yl]-, N-[(5R,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]benzamide, N-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]benzamide
| Molecular Formula | C30H42N2O2 |
|---|---|
| Molecular Weight | 462.32 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.32462 |
| Heavy Atoms | 34 |
| Complexity | 843.0 |
Chemical Identifiers
| CAS Number | 128255-16-3 |
|---|---|
| SMILES | CC(C1CCC2C1(CCC3C2CCC4C3(CC=C(C4=O)NC(=O)C5=CC=CC=C5)C)C)N(C)C |
| InChIKey | ZMAOKPMWBVUQPK-UHFFFAOYSA-N |
Product Overview
Axillaridine A (CAS 128255-16-3), with molecular formula C30H42N2O2 and molecular weight 462.32 g/mol. IUPAC: N-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]benzamide.
Chemical Property Profile of Axillaridine A
Property Insights of Axillaridine A
The XLogP value of 6.6 indicates that Axillaridine A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, Axillaridine A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Axillaridine A has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Axillaridine A?
The CAS number of Axillaridine A is 128255-16-3.
What is the molecular formula of Axillaridine A?
The molecular formula of Axillaridine A is C30H42N2O2.
What is the molecular weight of Axillaridine A?
The molecular weight of Axillaridine A is 462.32 g/mol.
Where can I buy Axillaridine A?
You can request a quote for Axillaridine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Axillaridine A?
Yes, KEHONG BIO provides custom synthesis services for Axillaridine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.