BAS 00866938
TL;DR: BAS 00866938 (CAS 313380-98-2) is a chemical compound with molecular formula C21H19F4N3O2 and molecular weight 421.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-fluorophenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione
Also Known As: BAS 00866938, 1-(2-fluorophenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione, 1-(2-fluorophenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrrolidine-2,5-dione, 1-(2-fluorophenyl)-3-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)pyrrolidine-2,5-dione, REGID_for_CID_2867506
| Molecular Formula | C21H19F4N3O2 |
|---|---|
| Molecular Weight | 421.14 g/mol |
| LogP | 3.2986 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.14133 |
| Heavy Atoms | 30 |
| Complexity | 970.719 |
Chemical Identifiers
| CAS Number | 313380-98-2 |
|---|---|
| SMILES | C1CN(CCN1C2CC(=O)N(C2=O)C3=CC=CC=C3F)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
BAS 00866938 (CAS 313380-98-2), with molecular formula C21H19F4N3O2 and molecular weight 421.14 g/mol. IUPAC: 1-(2-fluorophenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 00866938
Property Insights of BAS 00866938
The XLogP value of 3.2986 indicates that BAS 00866938 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.86 Ų, BAS 00866938 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00866938 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00866938?
The CAS number of BAS 00866938 is 313380-98-2.
What is the molecular formula of BAS 00866938?
The molecular formula of BAS 00866938 is C21H19F4N3O2.
What is the molecular weight of BAS 00866938?
The molecular weight of BAS 00866938 is 421.14 g/mol.
Where can I buy BAS 00866938?
You can request a quote for BAS 00866938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00866938?
Yes, KEHONG BIO provides custom synthesis services for BAS 00866938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.