![N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide structure](/static/products/4284/428486-42-4.webp)
N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide
TL;DR: N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide (CAS 428486-42-4) is a chemical compound with molecular formula C25H24ClN3O3S and molecular weight 481.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide
Also Known As: N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide, N-[3-({[(4-butoxyphenyl)carbonyl]carbamothioyl}amino)phenyl]-2-chlorobenzamide, N-[3-({[(4-BUTOXYPHENYL)FORMAMIDO]METHANETHIOYL}AMINO)PHENYL]-2-CHLOROBENZAMIDE
| Molecular Formula | C25H24ClN3O3S |
|---|---|
| Molecular Weight | 481.12 g/mol |
| LogP | 5.898 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 481.12268 |
| Heavy Atoms | 33 |
| Complexity | 1135.7509 |
Chemical Identifiers
| CAS Number | 428486-42-4 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3Cl |
Product Overview
N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide (CAS 428486-42-4), with molecular formula C25H24ClN3O3S and molecular weight 481.12 g/mol. IUPAC: N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide.
Chemical Property Profile of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide
Property Insights of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide
The XLogP value of 5.898 indicates that N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide 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 N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide. Following Lipinski's Rule of Five, N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide?
The CAS number of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide is 428486-42-4.
What is the molecular formula of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide?
The molecular formula of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide is C25H24ClN3O3S.
What is the molecular weight of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide?
The molecular weight of N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide is 481.12 g/mol.
Where can I buy N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide?
You can request a quote for N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-[(4-butoxybenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.