![4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide structure](/static/products/4016/401615-07-4.webp)
4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
TL;DR: 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 401615-07-4) is a chemical compound with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
Also Known As: AB00111064-01, 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide, N-{[4-(propanoylamino)phenyl]carbamothioyl}biphenyl-4-carboxamide, N-[4-({[(4-phenylphenyl)carbonylamino]thioxomethyl}amino)phenyl]propanamide
| Molecular Formula | C23H21N3O2S |
|---|---|
| Molecular Weight | 403.14 g/mol |
| LogP | 4.8289 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.13544 |
| Heavy Atoms | 29 |
| Complexity | 1000.5576 |
Chemical Identifiers
| CAS Number | 401615-07-4 |
|---|---|
| SMILES | CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3 |
Product Overview
4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 401615-07-4), with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol. IUPAC: 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
Property Insights of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
The XLogP value of 4.8289 indicates that 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide has 3 hydrogen bond donor(s) and 3 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 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The CAS number of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is 401615-07-4.
What is the molecular formula of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular formula of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is C23H21N3O2S.
What is the molecular weight of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular weight of 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is 403.14 g/mol.
Where can I buy 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
You can request a quote for 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-phenyl-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.