BAS 02378729
TL;DR: BAS 02378729 (CAS 335403-06-0) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one
Also Known As: BAS 02378729, 3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one, 4-acetyl-3-hydroxy-5-(4-isopropylphenyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one, (4E)-4-(1-hydroxyethylidene)-5-[4-(propan-2-yl)phenyl]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione, 4-acetyl-3-hydroxy-5-(4-isopropylphenyl)-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 3.6896 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 854.5847 |
Chemical Identifiers
| CAS Number | 335403-06-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C |
Product Overview
BAS 02378729 (CAS 335403-06-0), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: 3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 02378729
Property Insights of BAS 02378729
The XLogP value of 3.6896 indicates that BAS 02378729 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 BAS 02378729. Following Lipinski's Rule of Five, BAS 02378729 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 BAS 02378729?
The CAS number of BAS 02378729 is 335403-06-0.
What is the molecular formula of BAS 02378729?
The molecular formula of BAS 02378729 is C21H22N2O3.
What is the molecular weight of BAS 02378729?
The molecular weight of BAS 02378729 is 350.16 g/mol.
Where can I buy BAS 02378729?
You can request a quote for BAS 02378729 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02378729?
Yes, KEHONG BIO provides custom synthesis services for BAS 02378729 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.