F3188-0080
TL;DR: F3188-0080 (CAS 1005117-99-6) is a chemical compound with molecular formula C25H18Cl2N2O5 and molecular weight 496.05927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Also Known As: F3188-0080, methyl 4-(3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenyltetrahydro-2H-pyrrolo[3,4-d]isoxazol-5(3H)-yl)benzoate, methyl 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate, methyl 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate, methyl 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Technical Specifications
| Molecular Formula | C25H18Cl2N2O5 |
| Molecular Weight | 496.05927 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 76.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.05927 Da |
| Heavy Atoms | 34 |
| Complexity | 798.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=C(C=C(C=C5)Cl)Cl |
| InChIKey | BHDBMIZMDLRZTN-UHFFFAOYSA-N |
Chemical Property Profile of F3188-0080
Property Insights of F3188-0080
The XLogP value of 5.1 indicates that F3188-0080 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F3188-0080. Following Lipinski's Rule of Five, F3188-0080 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F3188-0080?
The CAS number of F3188-0080 is 1005117-99-6.
What is the molecular formula of F3188-0080?
The molecular formula of F3188-0080 is C25H18Cl2N2O5.
What is the molecular weight of F3188-0080?
The molecular weight of F3188-0080 is 496.05927 g/mol.
Where can I buy F3188-0080?
You can request a quote for F3188-0080 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F3188-0080?
Yes, CoreyChem provides custom synthesis services for F3188-0080 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.