C25H18ClF3N2O4
TL;DR: C25H18ClF3N2O4 (CAS 1023169-43-8) is a chemical compound with molecular formula C25H18ClF3N2O4 and molecular weight 502.09073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(3-chloro-2-methylphenyl)-2-phenyl-3-[4-(trifluoromethoxy)phenyl]-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: 5-(3-chloro-2-methylphenyl)-2-phenyl-3-(4-(trifluoromethoxy)phenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(3-chloro-2-methylphenyl)-2-phenyl-3-[4-(trifluoromethoxy)phenyl]-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 5-(3-chloro-2-methylphenyl)-2-phenyl-3-[4-(trifluoromethoxy)phenyl]dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, C25H18ClF3N2O4
Technical Specifications
| Molecular Formula | C25H18ClF3N2O4 |
| Molecular Weight | 502.09073 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 502.09073 Da |
| Heavy Atoms | 35 |
| Complexity | 800.0 |
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC(F)(F)F |
| InChIKey | ATNWEVGNFUJBPF-UHFFFAOYSA-N |
Chemical Property Profile of C25H18ClF3N2O4
Property Insights of C25H18ClF3N2O4
The XLogP value of 6.2 indicates that C25H18ClF3N2O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, C25H18ClF3N2O4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C25H18ClF3N2O4 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C25H18ClF3N2O4?
The CAS number of C25H18ClF3N2O4 is 1023169-43-8.
What is the molecular formula of C25H18ClF3N2O4?
The molecular formula of C25H18ClF3N2O4 is C25H18ClF3N2O4.
What is the molecular weight of C25H18ClF3N2O4?
The molecular weight of C25H18ClF3N2O4 is 502.09073 g/mol.
Where can I buy C25H18ClF3N2O4?
You can request a quote for C25H18ClF3N2O4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C25H18ClF3N2O4?
Yes, CoreyChem provides custom synthesis services for C25H18ClF3N2O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.