A3335/0141640
TL;DR: A3335/0141640 (CAS 590378-38-4) is a chemical compound with molecular formula C23H22F3N3O4 and molecular weight 461.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Also Known As: A3335/0141640, 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione, 3-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]-1-[4-(TRIFLUOROMETHYL)PHENYL]DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C23H22F3N3O4 |
|---|---|
| Molecular Weight | 461.16 g/mol |
| LogP | 2.8838 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 461.15625 |
| Heavy Atoms | 33 |
| Complexity | 1065.6116 |
Chemical Identifiers
| CAS Number | 590378-38-4 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4CC(=O)N(C4=O)C5=CC=C(C=C5)C(F)(F)F |
Product Overview
A3335/0141640 (CAS 590378-38-4), with molecular formula C23H22F3N3O4 and molecular weight 461.16 g/mol. IUPAC: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-[4-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione.
Chemical Property Profile of A3335/0141640
Property Insights of A3335/0141640
The XLogP value of 2.8838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3335/0141640. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for A3335/0141640. Following Lipinski's Rule of Five, A3335/0141640 has 0 hydrogen bond donor(s) and 6 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 A3335/0141640?
The CAS number of A3335/0141640 is 590378-38-4.
What is the molecular formula of A3335/0141640?
The molecular formula of A3335/0141640 is C23H22F3N3O4.
What is the molecular weight of A3335/0141640?
The molecular weight of A3335/0141640 is 461.16 g/mol.
Where can I buy A3335/0141640?
You can request a quote for A3335/0141640 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3335/0141640?
Yes, KEHONG BIO provides custom synthesis services for A3335/0141640 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.