N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide
TL;DR: N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide (CAS 304510-64-3) is a chemical compound with molecular formula C14H9FN2OS and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide
Also Known As: N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide, n-(benzo[d]thiazol-2-yl)-3-fluorobenzamide, N-benzothiazol-2-yl(3-fluorophenyl)carboxamide, N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-fluorobenzamide
| Molecular Formula | C14H9FN2OS |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.04196 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 304510-64-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)F |
| InChIKey | CIJSDXMPGRWAOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide (CAS 304510-64-3), with molecular formula C14H9FN2OS and molecular weight 272.04 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide
Property Insights of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide
The XLogP value of 3.6 indicates that N-(1,3-benzothiazol-2-yl)-3-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-(1,3-benzothiazol-2-yl)-3-fluorobenzamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-3-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-(1,3-benzothiazol-2-yl)-3-fluorobenzamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide is 304510-64-3.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide is C14H9FN2OS.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide is 272.04 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.