N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide
TL;DR: N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide (CAS 79091-18-2) is a chemical compound with molecular formula C14H8ClFN2OS and molecular weight 306.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide
Also Known As: BAS 06184982, N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide, BIM-0030895.P001, N-(6-chlorobenzo[d]thiazol-2-yl)-2-fluorobenzamide, AE-848/36200037
| Molecular Formula | C14H8ClFN2OS |
|---|---|
| Molecular Weight | 306.00 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.003 |
| Heavy Atoms | 20 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 79091-18-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)F |
| InChIKey | VPOIMNOKLCUTLN-UHFFFAOYSA-N |
Product Overview
N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide (CAS 79091-18-2), with molecular formula C14H8ClFN2OS and molecular weight 306.00 g/mol. IUPAC: N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide.
Chemical Property Profile of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide
Property Insights of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide
The XLogP value of 4.3 indicates that N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide. Following Lipinski's Rule of Five, N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide has 1 hydrogen bond donor(s) and 4 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 N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The CAS number of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide is 79091-18-2.
What is the molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide is C14H8ClFN2OS.
What is the molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide is 306.00 g/mol.
Where can I buy N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
You can request a quote for N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-chloro-1,3-benzothiazol-2-yl)-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.