3G-035
TL;DR: 3G-035 (CAS 338407-12-8) is a chemical compound with molecular formula C17H14Cl2F3N3O and molecular weight 403.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(dimethylaminomethylidene)acetamide
Also Known As: 3G-035, 2-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-[(dimethylamino)methylene]acetamide, 2-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(dimethylaminomethylidene)acetamide, 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(4-chlorophenyl)-N-[(1E)-(dimethylamino)methylidene]acetamide
| Molecular Formula | C17H14Cl2F3N3O |
|---|---|
| Molecular Weight | 403.05 g/mol |
| LogP | 4.6556 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.0466 |
| Heavy Atoms | 26 |
| Complexity | 820.9931 |
Chemical Identifiers
| CAS Number | 338407-12-8 |
|---|---|
| SMILES | CN(C)C=NC(=O)C(C1=CC=C(C=C1)Cl)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
3G-035 (CAS 338407-12-8), with molecular formula C17H14Cl2F3N3O and molecular weight 403.05 g/mol. IUPAC: 2-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(dimethylaminomethylidene)acetamide.
Chemical Property Profile of 3G-035
Property Insights of 3G-035
The XLogP value of 4.6556 indicates that 3G-035 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.56 Ų, 3G-035 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3G-035 has 0 hydrogen bond donor(s) and 2 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 3G-035?
The CAS number of 3G-035 is 338407-12-8.
What is the molecular formula of 3G-035?
The molecular formula of 3G-035 is C17H14Cl2F3N3O.
What is the molecular weight of 3G-035?
The molecular weight of 3G-035 is 403.05 g/mol.
Where can I buy 3G-035?
You can request a quote for 3G-035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3G-035?
Yes, KEHONG BIO provides custom synthesis services for 3G-035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.