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N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide structure
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N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide

TL;DR: N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide (CAS 1022873-90-0) is a chemical compound with molecular formula C16H14FN3O3S and molecular weight 347.074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide

Also Known As: 2-(4-fluorophenoxy)-N-{[(phenylformamido)methanethioyl]amino}acetamide, N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide, N-({2-[2-(4-fluorophenoxy)acetyl]hydrazino}carbothioyl)benzenecarboxamide, 1-(2-(4-FLUOROPHENOXY)ACETYL)-4-BENZOYLTHIOSEMICARBAZIDE, N-[[[2-(4-fluorophenoxy)acetyl]amino]thiocarbamoyl]benzamide

CAS Number
1022873-90-0
Molecular Formula
C16H14FN3O3S
Molecular Weight
347.074 g/mol
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Technical Specifications

Molecular FormulaC16H14FN3O3S
Molecular Weight347.074 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)112.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds4
Exact Mass347.074 Da
Heavy Atoms24
Complexity450.0
SMILESC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)F
InChIKeyGIVBVVXRPPJOLJ-UHFFFAOYSA-N

Chemical Property Profile of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide

XLogP
3.3
TPSA (Topological Polar Surface Area)
112.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
4
Heavy Atoms
24
Complexity
450.0
Exact Mass
347.074
Monoisotopic Mass
347.074
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide

The XLogP value of 3.3 indicates that N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide. Following Lipinski's Rule of Five, N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide?

The CAS number of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide is 1022873-90-0.

What is the molecular formula of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide?

The molecular formula of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide is C16H14FN3O3S.

What is the molecular weight of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide?

The molecular weight of N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide is 347.074 g/mol.

Where can I buy N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide?

You can request a quote for N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide?

Yes, CoreyChem provides custom synthesis services for N-[[[2-(4-fluorophenoxy)acetyl]amino]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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