BAS 01247850
TL;DR: BAS 01247850 (CAS 332170-16-8) is a chemical compound with molecular formula C22H22N2O6 and molecular weight 410.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-butyl-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: BAS 01247850, 1-butyl-3-hydroxy-4-(4-methoxybenzoyl)-5-(4-nitrophenyl)-1H-pyrrol-2(5H)-one, (4E)-1-butyl-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione, (4E)-1-butyl-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
| Molecular Formula | C22H22N2O6 |
|---|---|
| Molecular Weight | 410.15 g/mol |
| LogP | 3.8252 |
| Topological Polar Surface Area | 109.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.1478 |
| Heavy Atoms | 30 |
| Complexity | 995.2928 |
Chemical Identifiers
| CAS Number | 332170-16-8 |
|---|---|
| SMILES | CCCCN1C(/C(=C(/C2=CC=C(C=C2)OC)\O)/C(=O)C1=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
BAS 01247850 (CAS 332170-16-8), with molecular formula C22H22N2O6 and molecular weight 410.15 g/mol. IUPAC: (4E)-1-butyl-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 01247850
Property Insights of BAS 01247850
The XLogP value of 3.8252 indicates that BAS 01247850 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01247850. Following Lipinski's Rule of Five, BAS 01247850 has 1 hydrogen bond donor(s) and 6 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 01247850?
The CAS number of BAS 01247850 is 332170-16-8.
What is the molecular formula of BAS 01247850?
The molecular formula of BAS 01247850 is C22H22N2O6.
What is the molecular weight of BAS 01247850?
The molecular weight of BAS 01247850 is 410.15 g/mol.
Where can I buy BAS 01247850?
You can request a quote for BAS 01247850 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01247850?
Yes, KEHONG BIO provides custom synthesis services for BAS 01247850 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.