4M-945
TL;DR: 4M-945 (CAS 338748-88-2) is a chemical compound with molecular formula C21H18Cl3F3N4O2 and molecular weight 520.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-N-(2,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxamide
Also Known As: 4M-945, 1-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-N-(2,4-dichlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide, 1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-N-(2,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxamide, 1-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)-N-(2,4-dichlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxamide
| Molecular Formula | C21H18Cl3F3N4O2 |
|---|---|
| Molecular Weight | 520.04 g/mol |
| LogP | 6.0076 |
| Topological Polar Surface Area | 74.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.04474 |
| Heavy Atoms | 33 |
| Complexity | 1122.4191 |
Chemical Identifiers
| CAS Number | 338748-88-2 |
|---|---|
| SMILES | CC1=C(CCC(=O)N1CCNC2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)NC3=C(C=C(C=C3)Cl)Cl |
Product Overview
4M-945 (CAS 338748-88-2), with molecular formula C21H18Cl3F3N4O2 and molecular weight 520.04 g/mol. IUPAC: 1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-N-(2,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxamide.
Chemical Property Profile of 4M-945
Property Insights of 4M-945
The XLogP value of 6.0076 indicates that 4M-945 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4M-945. Following Lipinski's Rule of Five, 4M-945 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4M-945?
The CAS number of 4M-945 is 338748-88-2.
What is the molecular formula of 4M-945?
The molecular formula of 4M-945 is C21H18Cl3F3N4O2.
What is the molecular weight of 4M-945?
The molecular weight of 4M-945 is 520.04 g/mol.
Where can I buy 4M-945?
You can request a quote for 4M-945 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4M-945?
Yes, KEHONG BIO provides custom synthesis services for 4M-945 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.