![4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide structure](/static/products/4284/428490-86-2.webp)
4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
TL;DR: 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide (CAS 428490-86-2) is a chemical compound with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
Also Known As: AB00108910-01, 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide, 4-butoxy-N-{[4-(morpholin-4-yl)phenyl]carbamothioyl}benzamide
| Molecular Formula | C22H27N3O3S |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 3.8289 |
| Topological Polar Surface Area | 62.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.1773 |
| Heavy Atoms | 29 |
| Complexity | 803.0571 |
Chemical Identifiers
| CAS Number | 428490-86-2 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCOCC3 |
Product Overview
4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide (CAS 428490-86-2), with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol. IUPAC: 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
Property Insights of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
The XLogP value of 3.8289 indicates that 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 5 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-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The CAS number of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is 428490-86-2.
What is the molecular formula of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The molecular formula of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is C22H27N3O3S.
What is the molecular weight of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The molecular weight of 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is 413.18 g/mol.
Where can I buy 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
You can request a quote for 4-butoxy-N-[(4-morpholin-4-ylphenyl)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-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.