1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one
TL;DR: 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one (CAS 49542-63-4) is a chemical compound with molecular formula C22H41NO2S and molecular weight 383.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-8-(3-octylthiiran-2-yl)octan-1-one
Also Known As: KST-1B4548, 1-(morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one, 1-morpholin-4-yl-8-(3-octylthiiran-2-yl)octan-1-one
| Molecular Formula | C22H41NO2S |
|---|---|
| Molecular Weight | 383.29 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 383.2858 |
| Heavy Atoms | 26 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 49542-63-4 |
|---|---|
| SMILES | CCCCCCCCC1C(S1)CCCCCCCC(=O)N2CCOCC2 |
| InChIKey | DPYGHXSTRIZSJD-UHFFFAOYSA-N |
Product Overview
1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one (CAS 49542-63-4), with molecular formula C22H41NO2S and molecular weight 383.29 g/mol. IUPAC: 1-morpholin-4-yl-8-(3-octylthiiran-2-yl)octan-1-one.
Chemical Property Profile of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one
Property Insights of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one
The XLogP value of 6.5 indicates that 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one has 0 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 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one?
The CAS number of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one is 49542-63-4.
What is the molecular formula of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one?
The molecular formula of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one is C22H41NO2S.
What is the molecular weight of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one?
The molecular weight of 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one is 383.29 g/mol.
Where can I buy 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one?
You can request a quote for 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(Morpholin-4-yl)-8-(3-octylthiiran-2-yl)octan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.