AB00096710-01
TL;DR: AB00096710-01 (CAS 332149-07-2) is a chemical compound with molecular formula C18H14ClNO3 and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-methylpyrrolidine-2,3-dione
Also Known As: AB00096710-01, (4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-methylpyrrolidine-2,3-dione, 4-benzoyl-5-(4-chlorophenyl)-3-hydroxy-1-methyl-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C18H14ClNO3 |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 3.3915 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.06622 |
| Heavy Atoms | 23 |
| Complexity | 796.77625 |
Chemical Identifiers
| CAS Number | 332149-07-2 |
|---|---|
| SMILES | CN1C(/C(=C(/C2=CC=CC=C2)\O)/C(=O)C1=O)C3=CC=C(C=C3)Cl |
Product Overview
AB00096710-01 (CAS 332149-07-2), with molecular formula C18H14ClNO3 and molecular weight 327.07 g/mol. IUPAC: (4E)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-methylpyrrolidine-2,3-dione.
Chemical Property Profile of AB00096710-01
Property Insights of AB00096710-01
The XLogP value of 3.3915 indicates that AB00096710-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, AB00096710-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00096710-01 has 1 hydrogen bond donor(s) and 3 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 AB00096710-01?
The CAS number of AB00096710-01 is 332149-07-2.
What is the molecular formula of AB00096710-01?
The molecular formula of AB00096710-01 is C18H14ClNO3.
What is the molecular weight of AB00096710-01?
The molecular weight of AB00096710-01 is 327.07 g/mol.
Where can I buy AB00096710-01?
You can request a quote for AB00096710-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00096710-01?
Yes, KEHONG BIO provides custom synthesis services for AB00096710-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.