ChemDiv1_014453
TL;DR: ChemDiv1_014453 (CAS 477242-18-5) is a chemical compound with molecular formula C25H25F3N4O2 and molecular weight 470.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-methoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: ChemDiv1_014453, AB01282233-01, F0532-1472, N,N-bis(2-methoxyethyl)-5-phenyl-7-(3-(trifluoromethyl)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, bis(2-methoxyethyl){5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[3,2-e]pyrimi din-4-yl}amine
| Molecular Formula | C25H25F3N4O2 |
|---|---|
| Molecular Weight | 470.19 g/mol |
| LogP | 5.2055 |
| Topological Polar Surface Area | 52.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.19296 |
| Heavy Atoms | 34 |
| Complexity | 1234.1285 |
Chemical Identifiers
| CAS Number | 477242-18-5 |
|---|---|
| SMILES | COCCN(CCOC)C1=NC=NC2=C1C(=CN2C3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4 |
Product Overview
ChemDiv1_014453 (CAS 477242-18-5), with molecular formula C25H25F3N4O2 and molecular weight 470.19 g/mol. IUPAC: N,N-bis(2-methoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of ChemDiv1_014453
Property Insights of ChemDiv1_014453
The XLogP value of 5.2055 indicates that ChemDiv1_014453 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.41 Ų, ChemDiv1_014453 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_014453 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_014453?
The CAS number of ChemDiv1_014453 is 477242-18-5.
What is the molecular formula of ChemDiv1_014453?
The molecular formula of ChemDiv1_014453 is C25H25F3N4O2.
What is the molecular weight of ChemDiv1_014453?
The molecular weight of ChemDiv1_014453 is 470.19 g/mol.
Where can I buy ChemDiv1_014453?
You can request a quote for ChemDiv1_014453 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014453?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.