![N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide structure](/static/products/587/587850-38-2.png)
N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide
TL;DR: N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide (CAS 587850-38-2) is a chemical compound with molecular formula C18H18FN3O3S and molecular weight 375.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide
Also Known As: AN-329/42100974, N-({2-[(2,4-dimethylphenoxy)acetyl]hydrazino}carbonothioyl)-4-fluorobenzamide, N-({2-[(2,4-dimethylphenoxy)acetyl]hydrazino}carbothioyl)-4-fluorobenzamide, N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide, acetic acid, (2,4-dimethylphenoxy)-, 2-[[(4-fluorobenzoyl)amino]thioxomethyl]hydrazide
| Molecular Formula | C18H18FN3O3S |
|---|---|
| Molecular Weight | 375.11 g/mol |
| LogP | 2.15704 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.1053 |
| Heavy Atoms | 26 |
| Complexity | 824.9311 |
Chemical Identifiers
| CAS Number | 587850-38-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)F)C |
Product Overview
N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide (CAS 587850-38-2), with molecular formula C18H18FN3O3S and molecular weight 375.11 g/mol. IUPAC: N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide.
Chemical Property Profile of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide
Property Insights of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide
The XLogP value of 2.15704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide. Following Lipinski's Rule of Five, N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide has 3 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-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide?
The CAS number of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide is 587850-38-2.
What is the molecular formula of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide?
The molecular formula of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide is C18H18FN3O3S.
What is the molecular weight of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide?
The molecular weight of N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide is 375.11 g/mol.
Where can I buy N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide?
You can request a quote for N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.