N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
TL;DR: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide (CAS 309925-20-0) is a chemical compound with molecular formula C15H8F3N3O3S and molecular weight 367.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
Also Known As: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide, N-(6-nitrobenzo[d]thiazol-2-yl)-3-(trifluoromethyl)benzamide, F0317-0200
| Molecular Formula | C15H8F3N3O3S |
|---|---|
| Molecular Weight | 367.02 g/mol |
| LogP | 4.4756 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.02383 |
| Heavy Atoms | 25 |
| Complexity | 984.8023 |
Chemical Identifiers
| CAS Number | 309925-20-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide (CAS 309925-20-0), with molecular formula C15H8F3N3O3S and molecular weight 367.02 g/mol. IUPAC: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
Property Insights of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
The XLogP value of 4.4756 indicates that N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide. Following Lipinski's Rule of Five, N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide 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-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide?
The CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide is 309925-20-0.
What is the molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide?
The molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide is C15H8F3N3O3S.
What is the molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide?
The molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide is 367.02 g/mol.
Where can I buy N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide?
You can request a quote for N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-nitro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.