BAS 06026998
TL;DR: BAS 06026998 (CAS 609332-34-5) is a chemical compound with molecular formula C23H23N3O3S and molecular weight 421.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,5-dimethylphenyl)-hydroxymethylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 06026998, 4-(2,5-dimethylbenzoyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-2-one, 4-[(2,5-dimethylphenyl)-hydroxymethylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
| Molecular Formula | C23H23N3O3S |
|---|---|
| Molecular Weight | 421.15 g/mol |
| LogP | 4.07344 |
| Topological Polar Surface Area | 75.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.14603 |
| Heavy Atoms | 30 |
| Complexity | 1100.9341 |
Chemical Identifiers
| CAS Number | 609332-34-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CS4)O |
Product Overview
BAS 06026998 (CAS 609332-34-5), with molecular formula C23H23N3O3S and molecular weight 421.15 g/mol. IUPAC: 4-[(2,5-dimethylphenyl)-hydroxymethylidene]-1-(3-imidazol-1-ylpropyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 06026998
Property Insights of BAS 06026998
The XLogP value of 4.07344 indicates that BAS 06026998 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06026998. Following Lipinski's Rule of Five, BAS 06026998 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 06026998?
The CAS number of BAS 06026998 is 609332-34-5.
What is the molecular formula of BAS 06026998?
The molecular formula of BAS 06026998 is C23H23N3O3S.
What is the molecular weight of BAS 06026998?
The molecular weight of BAS 06026998 is 421.15 g/mol.
Where can I buy BAS 06026998?
You can request a quote for BAS 06026998 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06026998?
Yes, KEHONG BIO provides custom synthesis services for BAS 06026998 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.