ChemDiv1_014533
TL;DR: ChemDiv1_014533 (CAS 477236-31-0) is a chemical compound with molecular formula C24H21F3N4O and molecular weight 438.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(oxolan-2-ylmethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: ChemDiv1_014533, F0532-0898, N-[(oxolan-2-yl)methyl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine, 5-phenyl-N-((tetrahydrofuran-2-yl)methyl)-7-(3-(trifluoromethyl)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, N-(oxolan-2-ylmethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C24H21F3N4O |
|---|---|
| Molecular Weight | 438.17 g/mol |
| LogP | 5.6972 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.16675 |
| Heavy Atoms | 32 |
| Complexity | 1231.2122 |
Chemical Identifiers
| CAS Number | 477236-31-0 |
|---|---|
| SMILES | C1CC(OC1)CNC2=C3C(=CN(C3=NC=N2)C4=CC=CC(=C4)C(F)(F)F)C5=CC=CC=C5 |
Product Overview
ChemDiv1_014533 (CAS 477236-31-0), with molecular formula C24H21F3N4O and molecular weight 438.17 g/mol. IUPAC: N-(oxolan-2-ylmethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of ChemDiv1_014533
Property Insights of ChemDiv1_014533
The XLogP value of 5.6972 indicates that ChemDiv1_014533 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, ChemDiv1_014533 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_014533 has 1 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 ChemDiv1_014533?
The CAS number of ChemDiv1_014533 is 477236-31-0.
What is the molecular formula of ChemDiv1_014533?
The molecular formula of ChemDiv1_014533 is C24H21F3N4O.
What is the molecular weight of ChemDiv1_014533?
The molecular weight of ChemDiv1_014533 is 438.17 g/mol.
Where can I buy ChemDiv1_014533?
You can request a quote for ChemDiv1_014533 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014533?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014533 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.