AB00116061-01
TL;DR: AB00116061-01 (CAS 384855-53-2) is a chemical compound with molecular formula C18H20Cl2N2O4 and molecular weight 398.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one
Also Known As: AB00116061-01, 3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one, 4-acetyl-5-(2,4-dichlorophenyl)-3-hydroxy-1-[2-(4-morpholinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C18H20Cl2N2O4 |
|---|---|
| Molecular Weight | 398.08 g/mol |
| LogP | 2.61 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.08002 |
| Heavy Atoms | 26 |
| Complexity | 759.55804 |
Chemical Identifiers
| CAS Number | 384855-53-2 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)N(C1C2=C(C=C(C=C2)Cl)Cl)CCN3CCOCC3)O |
Product Overview
AB00116061-01 (CAS 384855-53-2), with molecular formula C18H20Cl2N2O4 and molecular weight 398.08 g/mol. IUPAC: 3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one.
Chemical Property Profile of AB00116061-01
Property Insights of AB00116061-01
The XLogP value of 2.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00116061-01. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00116061-01. Following Lipinski's Rule of Five, AB00116061-01 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 AB00116061-01?
The CAS number of AB00116061-01 is 384855-53-2.
What is the molecular formula of AB00116061-01?
The molecular formula of AB00116061-01 is C18H20Cl2N2O4.
What is the molecular weight of AB00116061-01?
The molecular weight of AB00116061-01 is 398.08 g/mol.
Where can I buy AB00116061-01?
You can request a quote for AB00116061-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00116061-01?
Yes, KEHONG BIO provides custom synthesis services for AB00116061-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.