BAS 00669979
TL;DR: BAS 00669979 (CAS 313956-35-3) is a chemical compound with molecular formula C21H18N2OS2 and molecular weight 378.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-(1-ethyl-6-methylquinolin-2-ylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00669979, 5-(1-ethyl-6-methyl-2(1H)-quinolinylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-(1-ethyl-6-methylquinolin-2-ylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one, 5-[(2E)-1-ETHYL-6-METHYL-1,2-DIHYDROQUINOLIN-2-YLIDENE]-3-PHENYL-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, 5-(1-ET-6-METHYL-2(1H)-QUINOLINYLIDENE)-3-PHENYL-2-THIOXO-1,3-THIAZOLIDIN-4-ONE
| Molecular Formula | C21H18N2OS2 |
|---|---|
| Molecular Weight | 378.09 g/mol |
| LogP | 5.12462 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.08606 |
| Heavy Atoms | 26 |
| Complexity | 963.2313 |
Chemical Identifiers
| CAS Number | 313956-35-3 |
|---|---|
| SMILES | CCN\1C2=C(C=C/C1=C\3/C(=O)N(C(=S)S3)C4=CC=CC=C4)C=C(C=C2)C |
Product Overview
BAS 00669979 (CAS 313956-35-3), with molecular formula C21H18N2OS2 and molecular weight 378.09 g/mol. IUPAC: (5E)-5-(1-ethyl-6-methylquinolin-2-ylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00669979
Property Insights of BAS 00669979
The XLogP value of 5.12462 indicates that BAS 00669979 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, BAS 00669979 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00669979 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00669979?
The CAS number of BAS 00669979 is 313956-35-3.
What is the molecular formula of BAS 00669979?
The molecular formula of BAS 00669979 is C21H18N2OS2.
What is the molecular weight of BAS 00669979?
The molecular weight of BAS 00669979 is 378.09 g/mol.
Where can I buy BAS 00669979?
You can request a quote for BAS 00669979 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00669979?
Yes, KEHONG BIO provides custom synthesis services for BAS 00669979 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.