7G-004
TL;DR: 7G-004 (CAS 339010-37-6) is a chemical compound with molecular formula C17H12Cl2F3N3O and molecular weight 401.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-[(4-chloroanilino)methylidene]-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-one
Also Known As: 7G-004, 3-[(4-chloroanilino)methylene]-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-pyrrolidinone, (3E)-3-[(4-chloroanilino)methylidene]-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrrolidin-2-one, (3E)-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-{[(4-chlorophenyl)amino]methylidene}pyrrolidin-2-one, 3-[[(4-Chlorophenyl)amino]methylene]-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-pyrrolidinone
| Molecular Formula | C17H12Cl2F3N3O |
|---|---|
| Molecular Weight | 401.03 g/mol |
| LogP | 5.1399 |
| Topological Polar Surface Area | 45.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.03094 |
| Heavy Atoms | 26 |
| Complexity | 866.54706 |
Chemical Identifiers
| CAS Number | 339010-37-6 |
|---|---|
| SMILES | C\1CN(C(=O)/C1=C/NC2=CC=C(C=C2)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
7G-004 (CAS 339010-37-6), with molecular formula C17H12Cl2F3N3O and molecular weight 401.03 g/mol. IUPAC: (3E)-3-[(4-chloroanilino)methylidene]-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-one.
Chemical Property Profile of 7G-004
Property Insights of 7G-004
The XLogP value of 5.1399 indicates that 7G-004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.23 Ų, 7G-004 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7G-004 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7G-004?
The CAS number of 7G-004 is 339010-37-6.
What is the molecular formula of 7G-004?
The molecular formula of 7G-004 is C17H12Cl2F3N3O.
What is the molecular weight of 7G-004?
The molecular weight of 7G-004 is 401.03 g/mol.
Where can I buy 7G-004?
You can request a quote for 7G-004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7G-004?
Yes, KEHONG BIO provides custom synthesis services for 7G-004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.