A3787/0160800
TL;DR: A3787/0160800 (CAS 727682-44-2) is a chemical compound with molecular formula C22H23ClFN3O3 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[4-(4-methoxyanilino)piperidin-1-yl]pyrrolidine-2,5-dione
Also Known As: A3787/0160800, 1-(3-chloro-4-fluorophenyl)-3-[4-(4-methoxyanilino)piperidin-1-yl]pyrrolidine-2,5-dione, 1-(3-chloro-4-fluorophenyl)-3-{4-[(4-methoxyphenyl)amino]piperidin-1-yl}pyrrolidine-2,5-dione, 1-(3-CHLORO-4-FLUOROPHENYL)-3-[4-(4-METHOXYANILINO)PIPERIDINO]DIHYDRO-1H-PYRROLE-2,5-DIONE, 1-(3-chloro-4-fluorophenyl)-3-{4-[(4-methoxyphenyl)amino]-1-piperidinyl}-2,5-pyrrolidinedione
| Molecular Formula | C22H23ClFN3O3 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 3.6961 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.1412 |
| Heavy Atoms | 30 |
| Complexity | 945.144 |
Chemical Identifiers
| CAS Number | 727682-44-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2CCN(CC2)C3CC(=O)N(C3=O)C4=CC(=C(C=C4)F)Cl |
Product Overview
A3787/0160800 (CAS 727682-44-2), with molecular formula C22H23ClFN3O3 and molecular weight 431.14 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[4-(4-methoxyanilino)piperidin-1-yl]pyrrolidine-2,5-dione.
Chemical Property Profile of A3787/0160800
Property Insights of A3787/0160800
The XLogP value of 3.6961 indicates that A3787/0160800 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3787/0160800. Following Lipinski's Rule of Five, A3787/0160800 has 1 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 A3787/0160800?
The CAS number of A3787/0160800 is 727682-44-2.
What is the molecular formula of A3787/0160800?
The molecular formula of A3787/0160800 is C22H23ClFN3O3.
What is the molecular weight of A3787/0160800?
The molecular weight of A3787/0160800 is 431.14 g/mol.
Where can I buy A3787/0160800?
You can request a quote for A3787/0160800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3787/0160800?
Yes, KEHONG BIO provides custom synthesis services for A3787/0160800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.