Sch 38516
TL;DR: Sch 38516 (CAS 128563-23-5) is a chemical compound with molecular formula C24H46N2O5 and molecular weight 442.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,7S,10R,11R)-10-[(2R,3R,4R,5S,6S)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,11-diethyl-7-methyl-azacyclotetradecan-2-one
Also Known As: 4-nornicotine, Sch 38516, (3R,7S,10R,11R)-10-[(2R,3R,4R,5S,6S)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,11-diethyl-7-methyl-azacyclotetradecan-2-one, Azacyclotetradecan-2-one, 10-((3-amino-3,6-dideoxy-alpha-L-talopyranosyl)oxy)-3,11-diethyl-7-methyl-, (3R-(3R*,7S*,10R*,11R*))-, (3R,7S,10R,11R)-10-((2R,3R,4R,5S,6S)-4-Amino-3,5-dihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-3,11-diethyl-7-methyl-azacyclotetradecan-2-one
| Molecular Formula | C24H46N2O5 |
|---|---|
| Molecular Weight | 442.34 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.34067 |
| Heavy Atoms | 31 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 128563-23-5 |
|---|---|
| SMILES | CC[C@@H]1CCCNC(=O)[C@@H](CCC[C@@H](CC[C@H]1O[C@H]2[C@@H]([C@@H]([C@@H]([C@@H](O2)C)O)N)O)C)CC |
| InChIKey | MJDWUOZLTDXLJL-PEFIXUBVSA-N |
Product Overview
Sch 38516 (CAS 128563-23-5), with molecular formula C24H46N2O5 and molecular weight 442.34 g/mol. IUPAC: (3R,7S,10R,11R)-10-[(2R,3R,4R,5S,6S)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,11-diethyl-7-methyl-azacyclotetradecan-2-one.
Chemical Property Profile of Sch 38516
Property Insights of Sch 38516
The XLogP value of 3.0 indicates that Sch 38516 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sch 38516. Following Lipinski's Rule of Five, Sch 38516 has 4 hydrogen bond donor(s) and 6 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 Sch 38516?
The CAS number of Sch 38516 is 128563-23-5.
What is the molecular formula of Sch 38516?
The molecular formula of Sch 38516 is C24H46N2O5.
What is the molecular weight of Sch 38516?
The molecular weight of Sch 38516 is 442.34 g/mol.
Where can I buy Sch 38516?
You can request a quote for Sch 38516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sch 38516?
Yes, KEHONG BIO provides custom synthesis services for Sch 38516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.