5G-901
TL;DR: 5G-901 (CAS 338761-10-7) is a chemical compound with molecular formula C18H17ClF3N3O2S and molecular weight 431.07 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]-1-oxa-4,8-diazaspiro[4.5]decan-4-yl]-thiophen-2-ylmethanone
Also Known As: 5G-901, {8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-oxa-4,8-diazaspiro[4.5]dec-4-yl}(2-thienyl)methanone, [8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1-oxa-4,8-diazaspiro[4.5]decan-4-yl]-thiophen-2-ylmethanone, [8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-oxa-1,8-diazaspiro[4.5]decan-1-yl]-thiophen-2-ylmethanone, 8-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(thiophene-2-carbonyl)-1-oxa-4,8-diazaspiro[4.5]decane
| Molecular Formula | C18H17ClF3N3O2S |
|---|---|
| Molecular Weight | 431.07 g/mol |
| LogP | 4.2844 |
| Topological Polar Surface Area | 45.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 431.0682 |
| Heavy Atoms | 28 |
| Complexity | 867.45593 |
Chemical Identifiers
| CAS Number | 338761-10-7 |
|---|---|
| SMILES | C1CN(CCC12N(CCO2)C(=O)C3=CC=CS3)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
5G-901 (CAS 338761-10-7), with molecular formula C18H17ClF3N3O2S and molecular weight 431.07 g/mol. IUPAC: [8-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-oxa-4,8-diazaspiro[4.5]decan-4-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of 5G-901
Property Insights of 5G-901
The XLogP value of 4.2844 indicates that 5G-901 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.67 Ų, 5G-901 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5G-901 has 0 hydrogen bond donor(s) and 5 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-901?
The CAS number of 5G-901 is 338761-10-7.
What is the molecular formula of 5G-901?
The molecular formula of 5G-901 is C18H17ClF3N3O2S.
What is the molecular weight of 5G-901?
The molecular weight of 5G-901 is 431.07 g/mol.
Where can I buy 5G-901?
You can request a quote for 5G-901 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-901?
Yes, KEHONG BIO provides custom synthesis services for 5G-901 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.