![N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide structure](/static/products/477/477557-71-4.png)
N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
TL;DR: N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide (CAS 477557-71-4) is a chemical compound with molecular formula C18H16FN3O4S2 and molecular weight 421.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
Also Known As: N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide, N-((6-fluorobenzo[d]thiazol-2-yl)carbamothioyl)-3,4,5-trimethoxybenzamide, N-[(6-fluorobenzothiazol-2-yl)thiocarbamoyl]-3,4,5-trimethoxy-benzamide
| Molecular Formula | C18H16FN3O4S2 |
|---|---|
| Molecular Weight | 421.06 g/mol |
| LogP | 3.588 |
| Topological Polar Surface Area | 81.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.05664 |
| Heavy Atoms | 28 |
| Complexity | 1029.4819 |
Chemical Identifiers
| CAS Number | 477557-71-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)F |
Product Overview
N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide (CAS 477557-71-4), with molecular formula C18H16FN3O4S2 and molecular weight 421.06 g/mol. IUPAC: N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide.
Chemical Property Profile of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
Property Insights of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
The XLogP value of 3.588 indicates that N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.71 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide has 2 hydrogen bond donor(s) and 7 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-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide?
The CAS number of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide is 477557-71-4.
What is the molecular formula of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide?
The molecular formula of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide is C18H16FN3O4S2.
What is the molecular weight of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide?
The molecular weight of N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide is 421.06 g/mol.
Where can I buy N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide?
You can request a quote for N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.