![4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide structure](/static/products/4285/428501-85-3.webp)
4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
TL;DR: 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide (CAS 428501-85-3) is a chemical compound with molecular formula C17H18ClN3O2S and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide
Also Known As: 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide, AP-970/40629901, N-(4-butoxybenzoyl)-N'-(5-chloro-2-pyridinyl)thiourea, 4-butoxy-N-((5-chloropyridin-2-yl)carbamothioyl)benzamide, 3-(4-BUTOXYBENZOYL)-1-(5-CHLOROPYRIDIN-2-YL)THIOUREA
| Molecular Formula | C17H18ClN3O2S |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 4.0407 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.0808 |
| Heavy Atoms | 24 |
| Complexity | 689.98676 |
Chemical Identifiers
| CAS Number | 428501-85-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Cl |
Product Overview
4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide (CAS 428501-85-3), with molecular formula C17H18ClN3O2S and molecular weight 363.08 g/mol. IUPAC: 4-butoxy-N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
Property Insights of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
The XLogP value of 4.0407 indicates that 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide has 2 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-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
The CAS number of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is 428501-85-3.
What is the molecular formula of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
The molecular formula of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is C17H18ClN3O2S.
What is the molecular weight of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
The molecular weight of 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is 363.08 g/mol.
Where can I buy 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
You can request a quote for 4-butoxy-N-[(5-chloropyridin-2-yl)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-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.