5G-906
TL;DR: 5G-906 (CAS 338761-20-9) is a chemical compound with molecular formula C17H20ClF3N4OS and molecular weight 420.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-prop-2-enyl-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide
Also Known As: 5G-906, N-allyl-8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(prop-2-en-1-yl)-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-prop-2-enyl-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-prop-2-enyl-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide
| Molecular Formula | C17H20ClF3N4OS |
|---|---|
| Molecular Weight | 420.10 g/mol |
| LogP | 3.443 |
| Topological Polar Surface Area | 40.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.09985 |
| Heavy Atoms | 27 |
| Complexity | 722.62036 |
Chemical Identifiers
| CAS Number | 338761-20-9 |
|---|---|
| SMILES | C=CCNC(=S)N1CCOC12CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
5G-906 (CAS 338761-20-9), with molecular formula C17H20ClF3N4OS and molecular weight 420.10 g/mol. IUPAC: 8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-prop-2-enyl-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide.
Chemical Property Profile of 5G-906
Property Insights of 5G-906
The XLogP value of 3.443 indicates that 5G-906 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.63 Ų, 5G-906 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5G-906 has 1 hydrogen bond donor(s) and 4 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 5G-906?
The CAS number of 5G-906 is 338761-20-9.
What is the molecular formula of 5G-906?
The molecular formula of 5G-906 is C17H20ClF3N4OS.
What is the molecular weight of 5G-906?
The molecular weight of 5G-906 is 420.10 g/mol.
Where can I buy 5G-906?
You can request a quote for 5G-906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-906?
Yes, KEHONG BIO provides custom synthesis services for 5G-906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.