![N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide structure](/static/products/3646/364601-27-4.webp)
N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide
TL;DR: N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide (CAS 364601-27-4) is a chemical compound with molecular formula C17H18BrN3OS and molecular weight 391.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-bromo-2-pyridinyl)carbamothioyl]-4-tert-butylbenzamide
Also Known As: N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide, AB00109160-01, AN-465/40769790, N-(5-bromo-2-pyridinyl)-N'-(4-tert-butylbenzoyl)thiourea
| Molecular Formula | C17H18BrN3OS |
|---|---|
| Molecular Weight | 391.04 g/mol |
| LogP | 4.2684 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 391.0354 |
| Heavy Atoms | 23 |
| Complexity | 706.11346 |
Chemical Identifiers
| CAS Number | 364601-27-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br |
Product Overview
N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide (CAS 364601-27-4), with molecular formula C17H18BrN3OS and molecular weight 391.04 g/mol. IUPAC: N-[(5-bromo-2-pyridinyl)carbamothioyl]-4-tert-butylbenzamide.
Chemical Property Profile of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide
Property Insights of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide
The XLogP value of 4.2684 indicates that N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide has 2 hydrogen bond donor(s) and 3 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]-4-tert-butylbenzamide?
The CAS number of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide is 364601-27-4.
What is the molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide?
The molecular formula of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide is C17H18BrN3OS.
What is the molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide?
The molecular weight of N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide is 391.04 g/mol.
Where can I buy N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide?
You can request a quote for N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide 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]-4-tert-butylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-bromopyridin-2-yl)carbamothioyl]-4-tert-butylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.