4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-
TL;DR: 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- (CAS 58893-16-6) is a chemical compound with molecular formula C27H43N3O2 and molecular weight 441.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-butan-2-yl-16-[3-(diethylamino)-2-hydroxypropyl]-3-methyl-3,16-diazapentacyclo[10.3.1.110,13.02,10.04,9]heptadeca-4,6,8-trien-17-ol
Also Known As: (17R)-alpha-((Diethylamino)methyl)-17-hydroxy-4,21-secoajmalan-4-ethanol, 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-, 8-(Butan-2-yl)-13-[3-(diethylamino)-2-hydroxypropyl]-5-methyl-5,5a,6,7,8,9,10,11-octahydro-6,10-epimino-9,11a-methanocycloocta[b]indol-12-ol, BRN 0721632, RefChem:284385
| Molecular Formula | C27H43N3O2 |
|---|---|
| Molecular Weight | 441.34 g/mol |
| LogP | 2.9451 |
| Topological Polar Surface Area | 50.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.33554 |
| Heavy Atoms | 32 |
| Complexity | 828.8744 |
Chemical Identifiers
| CAS Number | 58893-16-6 |
|---|---|
| SMILES | CCC(C)C1CC2C3C4(CC(C1C4O)N2CC(CN(CC)CC)O)C5=CC=CC=C5N3C |
Product Overview
4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- (CAS 58893-16-6), with molecular formula C27H43N3O2 and molecular weight 441.34 g/mol. IUPAC: 14-butan-2-yl-16-[3-(diethylamino)-2-hydroxypropyl]-3-methyl-3,16-diazapentacyclo[10.3.1.110,13.02,10.04,9]heptadeca-4,6,8-trien-17-ol.
Chemical Property Profile of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-
Property Insights of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-
The XLogP value of 2.9451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-. With a topological polar surface area (TPSA) of 50.18 Ų, 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- has 2 hydrogen bond donor(s) and 5 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 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-?
The CAS number of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- is 58893-16-6.
What is the molecular formula of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-?
The molecular formula of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- is C27H43N3O2.
What is the molecular weight of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-?
The molecular weight of 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- is 441.34 g/mol.
Where can I buy 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-?
You can request a quote for 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)-?
Yes, KEHONG BIO provides custom synthesis services for 4,21-Secoajmalan-4-ethanol, alpha-((diethylamino)methyl)-17-hydroxy-, (17R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.