BAS 02589906
TL;DR: BAS 02589906 (CAS 374922-61-9) is a chemical compound with molecular formula C15H15BrN2O3S and molecular weight 382.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-ethylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
Also Known As: BAS 02589906, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-ethylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(ethylthio)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-ethylthio-6-oxo-1,4,5-trihydropyridine -3-carbonitrile
| Molecular Formula | C15H15BrN2O3S |
|---|---|
| Molecular Weight | 382.00 g/mol |
| LogP | 3.25508 |
| Topological Polar Surface Area | 82.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.9987 |
| Heavy Atoms | 22 |
| Complexity | 682.1005 |
Chemical Identifiers
| CAS Number | 374922-61-9 |
|---|---|
| SMILES | CCSC1=C(C(CC(=O)N1)C2=CC(=C(C(=C2)Br)O)OC)C#N |
Product Overview
BAS 02589906 (CAS 374922-61-9), with molecular formula C15H15BrN2O3S and molecular weight 382.00 g/mol. IUPAC: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-ethylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile.
Chemical Property Profile of BAS 02589906
Property Insights of BAS 02589906
The XLogP value of 3.25508 indicates that BAS 02589906 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.35 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02589906. Following Lipinski's Rule of Five, BAS 02589906 has 2 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 02589906?
The CAS number of BAS 02589906 is 374922-61-9.
What is the molecular formula of BAS 02589906?
The molecular formula of BAS 02589906 is C15H15BrN2O3S.
What is the molecular weight of BAS 02589906?
The molecular weight of BAS 02589906 is 382.00 g/mol.
Where can I buy BAS 02589906?
You can request a quote for BAS 02589906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02589906?
Yes, KEHONG BIO provides custom synthesis services for BAS 02589906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.