Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-
TL;DR: Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- (CAS 88735-39-1) is a chemical compound with molecular formula C17H18N4S and molecular weight 310.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-N-phenyldiazenyl-1,3-benzothiazol-2-imine
Also Known As: 3-butyl-N-phenyldiazenyl-1,3-benzothiazol-2-imine, Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-, Benzothiazole,3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene), 3-butyl-2-[(2E)-3-phenyltriaz-2-en-1-ylidene]-2,3-dihydro-1,3-benzothiazole
| Molecular Formula | C17H18N4S |
|---|---|
| Molecular Weight | 310.13 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.1252 |
| Heavy Atoms | 22 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 88735-39-1 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2SC1=NN=NC3=CC=CC=C3 |
| InChIKey | ORUUELFNVIDKIF-UHFFFAOYSA-N |
Product Overview
Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- (CAS 88735-39-1), with molecular formula C17H18N4S and molecular weight 310.13 g/mol. IUPAC: 3-butyl-N-phenyldiazenyl-1,3-benzothiazol-2-imine.
Chemical Property Profile of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-
Property Insights of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-
The XLogP value of 5.5 indicates that Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-. Following Lipinski's Rule of Five, Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- 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 Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-?
The CAS number of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- is 88735-39-1.
What is the molecular formula of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-?
The molecular formula of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- is C17H18N4S.
What is the molecular weight of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-?
The molecular weight of Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- is 310.13 g/mol.
Where can I buy Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-?
You can request a quote for Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 3-butyl-2,3-dihydro-2-(3-phenyl-2-triazenylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.