![2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate structure](/static/products/5322/5322-97-4.webp)
2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate
TL;DR: 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate (CAS 5322-97-4) is a chemical compound with molecular formula C39H73NO3S2 and molecular weight 667.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl-[8-(3-octylthiiran-2-yl)octanoyl]amino]ethyl 8-(3-octylthiiran-2-yl)octanoate
Also Known As: 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate, 2-[methyl-[8-(3-octylthiiran-2-yl)octanoyl]amino]ethyl 8-(3-, 2-[methyl-[8-(3-octylthiiran-2-yl)octanoyl]amino]ethyl 8-(3-octylthiiran-2-yl)octanoate, 2-[N-METHYL-8-(3-OCTYLTHIIRAN-2-YL)OCTANAMIDO]ETHYL 8-(3-OCTYLTHIIRAN-2-YL)OCTANOATE, 2-Thiiraneoctanoicacid, 3-octyl-, 2-[methyl[8-(3-octyl-2-thiiranyl)-1-oxooctyl]amino]ethyl ester
| Molecular Formula | C39H73NO3S2 |
|---|---|
| Molecular Weight | 667.50 g/mol |
| LogP | 13.9 |
| Topological Polar Surface Area | 97.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 34 |
| Exact Mass | 667.5032 |
| Heavy Atoms | 45 |
| Complexity | 735.0 |
Chemical Identifiers
| CAS Number | 5322-97-4 |
|---|---|
| SMILES | CCCCCCCCC1C(S1)CCCCCCCC(=O)N(C)CCOC(=O)CCCCCCCC2C(S2)CCCCCCCC |
| InChIKey | RGOJTVCZEWUMKE-UHFFFAOYSA-N |
Product Overview
2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate (CAS 5322-97-4), with molecular formula C39H73NO3S2 and molecular weight 667.50 g/mol. IUPAC: 2-[methyl-[8-(3-octylthiiran-2-yl)octanoyl]amino]ethyl 8-(3-octylthiiran-2-yl)octanoate.
Chemical Property Profile of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate
Property Insights of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate
The XLogP value of 13.9 indicates that 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate. Following Lipinski's Rule of Five, 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate?
The CAS number of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate is 5322-97-4.
What is the molecular formula of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate?
The molecular formula of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate is C39H73NO3S2.
What is the molecular weight of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate?
The molecular weight of 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate is 667.50 g/mol.
Where can I buy 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate?
You can request a quote for 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-{methyl[8-(3-octylthiiran-2-yl)octanoyl]amino}ethyl 8-(3-octylthiiran-2-yl)octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.