BAS 01108264
TL;DR: BAS 01108264 (CAS 313381-91-8) is a chemical compound with molecular formula C22H18N4O5S and molecular weight 450.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl (2Z)-5-amino-3-oxo-7-pyridin-3-yl-2-(pyridin-3-ylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Also Known As: BAS 01108264, dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-(pyridin-3-ylmethylidene)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate, (Z)-dimethyl 5-amino-3-oxo-7-(pyridin-3-yl)-2-(pyridin-3-ylmethylene)-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate, 5-Amino-3-oxo-7-pyridin-3-yl-2-[1-pyridin-3-yl-meth-(E)-ylidene]-2,3-dihydro-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid dimethyl ester, 6,8-DIMETHYL (2Z)-5-AMINO-3-OXO-7-(PYRIDIN-3-YL)-2-[(PYRIDIN-3-YL)METHYLIDENE]-2H,3H,7H-[1,3]THIAZOLO[3,2-A]PYRIDINE-6,8-DICARBOXYLATE
| Molecular Formula | C22H18N4O5S |
|---|---|
| Molecular Weight | 450.10 g/mol |
| LogP | -0.05 |
| Topological Polar Surface Area | 126.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.0998 |
| Heavy Atoms | 32 |
| Complexity | 1407.993 |
Chemical Identifiers
| CAS Number | 313381-91-8 |
|---|---|
| SMILES | COC(=O)C1=C(N2C(=C(C1C3=CN=CC=C3)C(=O)OC)S/C(=C\C4=CN=CC=C4)/C2=O)N |
Product Overview
BAS 01108264 (CAS 313381-91-8), with molecular formula C22H18N4O5S and molecular weight 450.10 g/mol. IUPAC: dimethyl (2Z)-5-amino-3-oxo-7-pyridin-3-yl-2-(pyridin-3-ylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate.
Chemical Property Profile of BAS 01108264
Property Insights of BAS 01108264
The XLogP value of -0.05 indicates that BAS 01108264 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01108264. Following Lipinski's Rule of Five, BAS 01108264 has 1 hydrogen bond donor(s) and 9 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 01108264?
The CAS number of BAS 01108264 is 313381-91-8.
What is the molecular formula of BAS 01108264?
The molecular formula of BAS 01108264 is C22H18N4O5S.
What is the molecular weight of BAS 01108264?
The molecular weight of BAS 01108264 is 450.10 g/mol.
Where can I buy BAS 01108264?
You can request a quote for BAS 01108264 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01108264?
Yes, KEHONG BIO provides custom synthesis services for BAS 01108264 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.