BAS 01054213
TL;DR: BAS 01054213 (CAS 298217-07-9) is a chemical compound with molecular formula C24H14N4O5S and molecular weight 470.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-5-amino-7-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Also Known As: BAS 01054213, (2E)-5-amino-7-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile, (2E)-5-AMINO-7-(2H-1,3-BENZODIOXOL-5-YL)-2-[(2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]-3-OXO-2H,3H,7H-[1,3]THIAZOLO[3,2-A]PYRIDINE-6,8-DICARBONITRILE, 5-Amino-7-benzo[1,3]dioxol-5-yl-2-benzo[1,3]dioxol-5-ylmethylene-3-oxo-2,3-dihydro-7H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile, 7-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-5-amino-2-(2H-benzo[3,4-d]1,3-dioxolen-5- ylmethylene)-3-oxo-4,7-dihydro-1,3-thiazolidino[3,2-a]pyridine-6,8-dicarbonitr ile
| Molecular Formula | C24H14N4O5S |
|---|---|
| Molecular Weight | 470.07 g/mol |
| LogP | 1.31856 |
| Topological Polar Surface Area | 132.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 470.06848 |
| Heavy Atoms | 34 |
| Complexity | 1685.7244 |
Chemical Identifiers
| CAS Number | 298217-07-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/3\C(=O)N4C(=C(C(C(=C4S3)C#N)C5=CC6=C(C=C5)OCO6)C#N)N |
Product Overview
BAS 01054213 (CAS 298217-07-9), with molecular formula C24H14N4O5S and molecular weight 470.07 g/mol. IUPAC: (2E)-5-amino-7-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile.
Chemical Property Profile of BAS 01054213
Property Insights of BAS 01054213
The XLogP value of 1.31856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01054213. The TPSA of 132.52 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01054213. Following Lipinski's Rule of Five, BAS 01054213 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 01054213?
The CAS number of BAS 01054213 is 298217-07-9.
What is the molecular formula of BAS 01054213?
The molecular formula of BAS 01054213 is C24H14N4O5S.
What is the molecular weight of BAS 01054213?
The molecular weight of BAS 01054213 is 470.07 g/mol.
Where can I buy BAS 01054213?
You can request a quote for BAS 01054213 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01054213?
Yes, KEHONG BIO provides custom synthesis services for BAS 01054213 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.