5G-905
TL;DR: 5G-905 (CAS 338761-18-5) is a chemical compound with molecular formula C20H19ClF3N5O3S and molecular weight 501.08 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-(4-nitrophenyl)-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide
Also Known As: 5G-905, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(4-nitrophenyl)-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide, 8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-nitrophenyl)-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(4-nitrophenyl)-4-oxa-1,8-diazaspiro[4.5]decane-1-carbothioamide
| Molecular Formula | C20H19ClF3N5O3S |
|---|---|
| Molecular Weight | 501.08 g/mol |
| LogP | 4.6877 |
| Topological Polar Surface Area | 83.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 501.08493 |
| Heavy Atoms | 33 |
| Complexity | 1061.9011 |
Chemical Identifiers
| CAS Number | 338761-18-5 |
|---|---|
| SMILES | C1CN(CCC12N(CCO2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
5G-905 (CAS 338761-18-5), with molecular formula C20H19ClF3N5O3S and molecular weight 501.08 g/mol. IUPAC: 8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-nitrophenyl)-1-oxa-4,8-diazaspiro[4.5]decane-4-carbothioamide.
Chemical Property Profile of 5G-905
Property Insights of 5G-905
The XLogP value of 4.6877 indicates that 5G-905 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 5G-905. Following Lipinski's Rule of Five, 5G-905 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5G-905?
The CAS number of 5G-905 is 338761-18-5.
What is the molecular formula of 5G-905?
The molecular formula of 5G-905 is C20H19ClF3N5O3S.
What is the molecular weight of 5G-905?
The molecular weight of 5G-905 is 501.08 g/mol.
Where can I buy 5G-905?
You can request a quote for 5G-905 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-905?
Yes, KEHONG BIO provides custom synthesis services for 5G-905 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.