5G-954
TL;DR: 5G-954 (CAS 338761-82-3) is a chemical compound with molecular formula C13H11ClF3N5O and molecular weight 345.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-oxopyrimidin-4-yl]-N,N-dimethylmethanimidamide
Also Known As: 5G-954, N'-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-oxopyrimidin-4-yl]-N,N-dimethylmethanimidamide, N'-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-oxo-1,2-dihydro-4-pyrimidinyl}-N,N-dimethyliminoformamide, (E)-N'-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-oxo-1,2-dihydropyrimidin-4-yl}-N,N-dimethylmethanimidamide
| Molecular Formula | C13H11ClF3N5O |
|---|---|
| Molecular Weight | 345.06 g/mol |
| LogP | 2.5211 |
| Topological Polar Surface Area | 63.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.06042 |
| Heavy Atoms | 23 |
| Complexity | 800.9275 |
Chemical Identifiers
| CAS Number | 338761-82-3 |
|---|---|
| SMILES | CN(C)C=NC1=NC(=O)N(C=C1)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
5G-954 (CAS 338761-82-3), with molecular formula C13H11ClF3N5O and molecular weight 345.06 g/mol. IUPAC: N'-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-oxopyrimidin-4-yl]-N,N-dimethylmethanimidamide.
Chemical Property Profile of 5G-954
Property Insights of 5G-954
The XLogP value of 2.5211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5G-954. The TPSA of 63.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 5G-954. Following Lipinski's Rule of Five, 5G-954 has 0 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-954?
The CAS number of 5G-954 is 338761-82-3.
What is the molecular formula of 5G-954?
The molecular formula of 5G-954 is C13H11ClF3N5O.
What is the molecular weight of 5G-954?
The molecular weight of 5G-954 is 345.06 g/mol.
Where can I buy 5G-954?
You can request a quote for 5G-954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-954?
Yes, KEHONG BIO provides custom synthesis services for 5G-954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.