![4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide structure](/static/products/4262/426232-16-8.webp)
4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide
TL;DR: 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 426232-16-8) is a chemical compound with molecular formula C21H25N3O3S and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide
Also Known As: 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide, 4-butoxy-N-{[3-(propanoylamino)phenyl]carbamothioyl}benzamide, N-[3-({[(4-butoxybenzoyl)amino]carbothioyl}amino)phenyl]propanamide, N-[3-({[(4-butoxyphenyl)carbonylamino]thioxomethyl}amino)phenyl]propanamide, N-[3-({[(4-BUTOXYPHENYL)FORMAMIDO]METHANETHIOYL}AMINO)PHENYL]PROPANAMIDE
| Molecular Formula | C21H25N3O3S |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 4.3408 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.16165 |
| Heavy Atoms | 28 |
| Complexity | 821.90045 |
Chemical Identifiers
| CAS Number | 426232-16-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CC |
Product Overview
4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 426232-16-8), with molecular formula C21H25N3O3S and molecular weight 399.16 g/mol. IUPAC: 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide
Property Insights of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide
The XLogP value of 4.3408 indicates that 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide 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 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide?
The CAS number of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide is 426232-16-8.
What is the molecular formula of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular formula of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide is C21H25N3O3S.
What is the molecular weight of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular weight of 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide is 399.16 g/mol.
Where can I buy 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide?
You can request a quote for 4-butoxy-N-[[3-(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-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-[[3-(propanoylamino)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.