BAS 00212612
TL;DR: BAS 00212612 (CAS 299408-97-2) is a chemical compound with molecular formula C22H22F3N3O3 and molecular weight 433.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione
Also Known As: BAS 00212612, 1-(4-methoxyphenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrrolidine-2,5-dione, 1-(4-methoxyphenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione, 1-(4-methoxyphenyl)-3-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)pyrrolidine-2,5-dione, 1-(4-methoxyphenyl)-3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-2,5-pyrrolidinedione
| Molecular Formula | C22H22F3N3O3 |
|---|---|
| Molecular Weight | 433.16 g/mol |
| LogP | 3.1681 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 433.16132 |
| Heavy Atoms | 31 |
| Complexity | 969.95667 |
Chemical Identifiers
| CAS Number | 299408-97-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
BAS 00212612 (CAS 299408-97-2), with molecular formula C22H22F3N3O3 and molecular weight 433.16 g/mol. IUPAC: 1-(4-methoxyphenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 00212612
Property Insights of BAS 00212612
The XLogP value of 3.1681 indicates that BAS 00212612 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, BAS 00212612 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00212612 has 0 hydrogen bond donor(s) and 5 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 00212612?
The CAS number of BAS 00212612 is 299408-97-2.
What is the molecular formula of BAS 00212612?
The molecular formula of BAS 00212612 is C22H22F3N3O3.
What is the molecular weight of BAS 00212612?
The molecular weight of BAS 00212612 is 433.16 g/mol.
Where can I buy BAS 00212612?
You can request a quote for BAS 00212612 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00212612?
Yes, KEHONG BIO provides custom synthesis services for BAS 00212612 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.