AB00113703-01
TL;DR: AB00113703-01 (CAS 378761-83-2) is a chemical compound with molecular formula C25H22N2O3 and molecular weight 398.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: AB00113703-01, 3-hydroxy-4-(4-methylbenzoyl)-5-(4-methylphenyl)-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one, 3-hydroxy-4-(4-methylbenzoyl)-1-(pyridin-3-ylmethyl)-5-(p-tolyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione, 3-hydroxy-5-(4-methylphenyl)-4-[(4-methylphenyl)carbonyl]-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C25H22N2O3 |
|---|---|
| Molecular Weight | 398.16 g/mol |
| LogP | 4.32034 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.16306 |
| Heavy Atoms | 30 |
| Complexity | 1117.3201 |
Chemical Identifiers
| CAS Number | 378761-83-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)C)\O)/C(=O)C(=O)N2CC4=CN=CC=C4 |
Product Overview
AB00113703-01 (CAS 378761-83-2), with molecular formula C25H22N2O3 and molecular weight 398.16 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AB00113703-01
Property Insights of AB00113703-01
The XLogP value of 4.32034 indicates that AB00113703-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00113703-01. Following Lipinski's Rule of Five, AB00113703-01 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 AB00113703-01?
The CAS number of AB00113703-01 is 378761-83-2.
What is the molecular formula of AB00113703-01?
The molecular formula of AB00113703-01 is C25H22N2O3.
What is the molecular weight of AB00113703-01?
The molecular weight of AB00113703-01 is 398.16 g/mol.
Where can I buy AB00113703-01?
You can request a quote for AB00113703-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00113703-01?
Yes, KEHONG BIO provides custom synthesis services for AB00113703-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.