BAS 01247892
TL;DR: BAS 01247892 (CAS 489443-79-0) is a chemical compound with molecular formula C21H18FNO3 and molecular weight 351.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-fluorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-prop-2-enylpyrrolidine-2,3-dione
Also Known As: BAS 01247892, 1-allyl-5-(4-fluorophenyl)-3-hydroxy-4-(4-methylbenzoyl)-1H-pyrrol-2(5H)-one, (4E)-5-(4-fluorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-prop-2-enylpyrrolidine-2,3-dione, 5-(4-fluorophenyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C21H18FNO3 |
|---|---|
| Molecular Weight | 351.13 g/mol |
| LogP | 3.74182 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.12708 |
| Heavy Atoms | 26 |
| Complexity | 897.85834 |
Chemical Identifiers
| CAS Number | 489443-79-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CC=C)C3=CC=C(C=C3)F)/O |
Product Overview
BAS 01247892 (CAS 489443-79-0), with molecular formula C21H18FNO3 and molecular weight 351.13 g/mol. IUPAC: (4E)-5-(4-fluorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-prop-2-enylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 01247892
Property Insights of BAS 01247892
The XLogP value of 3.74182 indicates that BAS 01247892 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, BAS 01247892 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01247892 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 BAS 01247892?
The CAS number of BAS 01247892 is 489443-79-0.
What is the molecular formula of BAS 01247892?
The molecular formula of BAS 01247892 is C21H18FNO3.
What is the molecular weight of BAS 01247892?
The molecular weight of BAS 01247892 is 351.13 g/mol.
Where can I buy BAS 01247892?
You can request a quote for BAS 01247892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01247892?
Yes, KEHONG BIO provides custom synthesis services for BAS 01247892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.