![3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione structure](/static/products/7673/767317-01-1.webp)
3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione
TL;DR: 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione (CAS 767317-01-1) is a chemical compound with molecular formula C13H15FN2O2S and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethylsulfanyl)-1-[(4-fluorophenyl)methyl]pyrrolidine-2,5-dione
Also Known As: A3811/0161777, 3-[(2-aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione, 3-((2-Aminoethyl)thio)-1-(4-fluorobenzyl)pyrrolidine-2,5-dione, 3-(2-aminoethylsulfanyl)-1-[(4-fluorophenyl)methyl]pyrrolidine-2,5-dione, 3-[(2-AMINOETHYL)SULFANYL]-1-(4-FLUOROBENZYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C13H15FN2O2S |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 1.1451 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.08383 |
| Heavy Atoms | 19 |
| Complexity | 478.0365 |
Chemical Identifiers
| CAS Number | 767317-01-1 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)CC2=CC=C(C=C2)F)SCCN |
Product Overview
3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione (CAS 767317-01-1), with molecular formula C13H15FN2O2S and molecular weight 282.08 g/mol. IUPAC: 3-(2-aminoethylsulfanyl)-1-[(4-fluorophenyl)methyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione
Property Insights of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione
The XLogP value of 1.1451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione. Following Lipinski's Rule of Five, 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione has 1 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 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione?
The CAS number of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione is 767317-01-1.
What is the molecular formula of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione?
The molecular formula of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione is C13H15FN2O2S.
What is the molecular weight of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione?
The molecular weight of 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione is 282.08 g/mol.
Where can I buy 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione?
You can request a quote for 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Aminoethyl)thio]-1-(4-fluorobenzyl)-2,5-pyrrolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.