BAS 06027013
TL;DR: BAS 06027013 (CAS 609332-64-1) is a chemical compound with molecular formula C23H23N3O4 and molecular weight 405.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(2,5-dimethylphenyl)-hydroxymethylidene]-5-(furan-2-yl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione
Also Known As: BAS 06027013, AS-871/41787081, 4-(2,5-dimethylbenzoyl)-5-(furan-2-yl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[(2,5-dimethylphenyl)-hydroxymethylidene]-5-(furan-2-yl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione, 4-(2,5-dimethylbenzoyl)-5-(2-furyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H23N3O4 |
|---|---|
| Molecular Weight | 405.17 g/mol |
| LogP | 3.60494 |
| Topological Polar Surface Area | 88.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.16885 |
| Heavy Atoms | 30 |
| Complexity | 1097.689 |
Chemical Identifiers
| CAS Number | 609332-64-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CO4)/O |
Product Overview
BAS 06027013 (CAS 609332-64-1), with molecular formula C23H23N3O4 and molecular weight 405.17 g/mol. IUPAC: (4E)-4-[(2,5-dimethylphenyl)-hydroxymethylidene]-5-(furan-2-yl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 06027013
Property Insights of BAS 06027013
The XLogP value of 3.60494 indicates that BAS 06027013 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06027013. Following Lipinski's Rule of Five, BAS 06027013 has 1 hydrogen bond donor(s) and 5 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 06027013?
The CAS number of BAS 06027013 is 609332-64-1.
What is the molecular formula of BAS 06027013?
The molecular formula of BAS 06027013 is C23H23N3O4.
What is the molecular weight of BAS 06027013?
The molecular weight of BAS 06027013 is 405.17 g/mol.
Where can I buy BAS 06027013?
You can request a quote for BAS 06027013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06027013?
Yes, KEHONG BIO provides custom synthesis services for BAS 06027013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.