![5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide structure](/static/products/4296/429640-32-4.webp)
5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
TL;DR: 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide (CAS 429640-32-4) is a chemical compound with molecular formula C22H20BrN3O2S and molecular weight 469.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
Also Known As: AB00111137-01, 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide, 5-bromo-N-{[3-(butanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide, 5-bromo-N-[[3-(butanoylamino)phenyl]thiocarbamoyl]naphthalene-1-carboxamide
| Molecular Formula | C22H20BrN3O2S |
|---|---|
| Molecular Weight | 469.05 g/mol |
| LogP | 5.4677 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.04596 |
| Heavy Atoms | 29 |
| Complexity | 1084.5953 |
Chemical Identifiers
| CAS Number | 429640-32-4 |
|---|---|
| SMILES | CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br |
Product Overview
5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide (CAS 429640-32-4), with molecular formula C22H20BrN3O2S and molecular weight 469.05 g/mol. IUPAC: 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide.
Chemical Property Profile of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
Property Insights of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
The XLogP value of 5.4677 indicates that 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide 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 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide. Following Lipinski's Rule of Five, 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The CAS number of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is 429640-32-4.
What is the molecular formula of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The molecular formula of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is C22H20BrN3O2S.
What is the molecular weight of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The molecular weight of 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is 469.05 g/mol.
Where can I buy 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
You can request a quote for 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-[[3-(butanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.