![1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile structure](/static/products/7257/725703-58-2.webp)
1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
TL;DR: 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile (CAS 725703-58-2) is a chemical compound with molecular formula C23H20N4S and molecular weight 384.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
Also Known As: 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile, 1-Amino-3-(4-(tert-butyl)phenyl)-3h-benzo[4,5]thiazolo[3,2-a]pyridine-2,4-dicarbonitrile, 13-amino-11-(4-tert-butylphenyl)-8-thia-1-azatricyclo[7.4.0.0,2,7]trideca-2(7),3,5,9,12-pentaene-10,12-dicarbonitrile, 4-Amino-2-(4-tert-butyl-phenyl)-2H-9-thia-4a-aza-fluorene-1,3-dicarbonitrile, 1-amino-3-[4-(tert-butyl)phenyl]-2-cyano-3H-pyrido[2,1-b][1,3]benzothiazol-4-yl cyanide
| Molecular Formula | C23H20N4S |
|---|---|
| Molecular Weight | 384.14 g/mol |
| LogP | 5.12266 |
| Topological Polar Surface Area | 76.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 384.14087 |
| Heavy Atoms | 28 |
| Complexity | 1105.017 |
Chemical Identifiers
| CAS Number | 725703-58-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2C(=C(N3C4=CC=CC=C4SC3=C2C#N)N)C#N |
Product Overview
1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile (CAS 725703-58-2), with molecular formula C23H20N4S and molecular weight 384.14 g/mol. IUPAC: 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile.
Chemical Property Profile of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
Property Insights of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
The XLogP value of 5.12266 indicates that 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile. Following Lipinski's Rule of Five, 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile?
The CAS number of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile is 725703-58-2.
What is the molecular formula of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile?
The molecular formula of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile is C23H20N4S.
What is the molecular weight of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile?
The molecular weight of 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile is 384.14 g/mol.
Where can I buy 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile?
You can request a quote for 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-amino-3-(4-tert-butylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.