BAS 02589917
TL;DR: BAS 02589917 (CAS 309280-02-2) is a chemical compound with molecular formula C18H16N2OS2 and molecular weight 340.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzylsulfanyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
Also Known As: BAS 02589917, BIM-0037206.P001, AB00100792-01, 6-benzylsulfanyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile, A2089/0087837
| Molecular Formula | C18H16N2OS2 |
|---|---|
| Molecular Weight | 340.07 g/mol |
| LogP | 4.3286 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.0704 |
| Heavy Atoms | 23 |
| Complexity | 786.85297 |
Chemical Identifiers
| CAS Number | 309280-02-2 |
|---|---|
| SMILES | CC1=C(SC=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3 |
Product Overview
BAS 02589917 (CAS 309280-02-2), with molecular formula C18H16N2OS2 and molecular weight 340.07 g/mol. IUPAC: 6-benzylsulfanyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile.
Chemical Property Profile of BAS 02589917
Property Insights of BAS 02589917
The XLogP value of 4.3286 indicates that BAS 02589917 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, BAS 02589917 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02589917 has 1 hydrogen bond donor(s) and 4 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 02589917?
The CAS number of BAS 02589917 is 309280-02-2.
What is the molecular formula of BAS 02589917?
The molecular formula of BAS 02589917 is C18H16N2OS2.
What is the molecular weight of BAS 02589917?
The molecular weight of BAS 02589917 is 340.07 g/mol.
Where can I buy BAS 02589917?
You can request a quote for BAS 02589917 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02589917?
Yes, KEHONG BIO provides custom synthesis services for BAS 02589917 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.