![N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide structure](/static/products/665/665013-16-1.png)
N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide
TL;DR: N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide (CAS 665013-16-1) is a chemical compound with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2-pyridinyl)carbamothioyl]-3-(2-methylpropoxy)benzamide
Also Known As: AN-465/41168887, N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide, N-(5-bromopyridin-2-yl)-N'-(3-isobutoxybenzoyl)thiourea, N-((5-bromopyridin-2-yl)carbamothioyl)-3-isobutoxybenzamide
| Molecular Formula | C17H18BrN3O2S |
|---|---|
| Molecular Weight | 407.03 g/mol |
| LogP | 4.0057 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.0303 |
| Heavy Atoms | 24 |
| Complexity | 720.0305 |
Chemical Identifiers
| CAS Number | 665013-16-1 |
|---|---|
| SMILES | CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br |
Product Overview
N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide (CAS 665013-16-1), with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol. IUPAC: N-[(5-bromo-2-pyridinyl)carbamothioyl]-3-(2-methylpropoxy)benzamide.
Chemical Property Profile of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide
Property Insights of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide
The XLogP value of 4.0057 indicates that N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)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 N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide. Following Lipinski's Rule of Five, N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)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 N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide?
The CAS number of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide is 665013-16-1.
What is the molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide?
The molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide is C17H18BrN3O2S.
What is the molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide?
The molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide is 407.03 g/mol.
Where can I buy N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide?
You can request a quote for N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.