Cgi 16343
TL;DR: Cgi 16343 (CAS 104065-98-7) is a chemical compound with molecular formula C17H21N3S2 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole
Also Known As: Cgi 16343, 2-tert-Butyl-6-isothiocyanato-5-(piperidin-1-yl)benzthiazole, 2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole, 2-TERT-BUTYL-6-ISOTHIOCYANATO-5-(PIPERIDIN-1-YL)-1,3-BENZOTHIAZOLE, Benzothiazole, 2-(1,1-dimethylethyl)-6-isothiocyanato-5-(1-piperidinyl)-
| Molecular Formula | C17H21N3S2 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.11768 |
| Heavy Atoms | 22 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 104065-98-7 |
|---|---|
| SMILES | CC(C)(C)C1=NC2=CC(=C(C=C2S1)N=C=S)N3CCCCC3 |
| InChIKey | PBIZIHYWQIESKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cgi 16343 (CAS 104065-98-7), with molecular formula C17H21N3S2 and molecular weight 331.12 g/mol. IUPAC: 2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole.
Chemical Property Profile of Cgi 16343
Property Insights of Cgi 16343
The XLogP value of 6.5 indicates that Cgi 16343 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Cgi 16343. Following Lipinski's Rule of Five, Cgi 16343 has 0 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 Cgi 16343?
The CAS number of Cgi 16343 is 104065-98-7.
What is the molecular formula of Cgi 16343?
The molecular formula of Cgi 16343 is C17H21N3S2.
What is the molecular weight of Cgi 16343?
The molecular weight of Cgi 16343 is 331.12 g/mol.
Where can I buy Cgi 16343?
You can request a quote for Cgi 16343 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cgi 16343?
Yes, KEHONG BIO provides custom synthesis services for Cgi 16343 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.