A3249/0138063
TL;DR: A3249/0138063 (CAS 587849-46-5) 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.
3-[4-(3-methoxyphenyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Also Known As: A3249/0138063, 3-[4-(3-methoxyphenyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione, 3-(4-(3-methoxyphenyl)piperazin-1-yl)-1-(4-(trifluoromethyl)phenyl)pyrrolidine-2,5-dione, 3-[4-(3-METHOXYPHENYL)PIPERAZINO]-1-[4-(TRIFLUOROMETHYL)PHENYL]DIHYDRO-1H-PYRROLE-2,5-DIONE
| 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 | 587849-46-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2CCN(CC2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)C(F)(F)F |
Product Overview
A3249/0138063 (CAS 587849-46-5), with molecular formula C22H22F3N3O3 and molecular weight 433.16 g/mol. IUPAC: 3-[4-(3-methoxyphenyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione.
Chemical Property Profile of A3249/0138063
Property Insights of A3249/0138063
The XLogP value of 3.1681 indicates that A3249/0138063 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, A3249/0138063 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3249/0138063 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 A3249/0138063?
The CAS number of A3249/0138063 is 587849-46-5.
What is the molecular formula of A3249/0138063?
The molecular formula of A3249/0138063 is C22H22F3N3O3.
What is the molecular weight of A3249/0138063?
The molecular weight of A3249/0138063 is 433.16 g/mol.
Where can I buy A3249/0138063?
You can request a quote for A3249/0138063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3249/0138063?
Yes, KEHONG BIO provides custom synthesis services for A3249/0138063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.