N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide
TL;DR: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide (CAS 895440-96-7) is a chemical compound with molecular formula C16H13FN2O3S and molecular weight 332.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide
Also Known As: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide, N-(5,6-dimethoxybenzo[d]thiazol-2-yl)-2-fluorobenzamide, F2525-0093
| Molecular Formula | C16H13FN2O3S |
|---|---|
| Molecular Weight | 332.06 g/mol |
| LogP | 3.7049 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.06308 |
| Heavy Atoms | 23 |
| Complexity | 837.8879 |
Chemical Identifiers
| CAS Number | 895440-96-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)N=C(S2)NC(=O)C3=CC=CC=C3F)OC |
Product Overview
N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide (CAS 895440-96-7), with molecular formula C16H13FN2O3S and molecular weight 332.06 g/mol. IUPAC: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide.
Chemical Property Profile of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide
Property Insights of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide
The XLogP value of 3.7049 indicates that N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide. Following Lipinski's Rule of Five, N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide has 1 hydrogen bond donor(s) and 5 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-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The CAS number of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide is 895440-96-7.
What is the molecular formula of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The molecular formula of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide is C16H13FN2O3S.
What is the molecular weight of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
The molecular weight of N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide is 332.06 g/mol.
Where can I buy N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
You can request a quote for N-(5,6-dimethoxy-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-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.