N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea
TL;DR: N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea (CAS 329777-80-2) is a chemical compound with molecular formula C13H12BrN3S and molecular weight 320.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-3-methyl-2-pyridinyl)-3-phenylthiourea
Also Known As: N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea, 1-(5-bromo-3-methylpyridin-2-yl)-3-phenylthiourea, 3-(5-bromo-3-methylpyridin-2-yl)-1-phenylthiourea, 1-(5-bromo-3-methyl-pyridin-2-yl)-3-phenyl-thiourea
| Molecular Formula | C13H12BrN3S |
|---|---|
| Molecular Weight | 320.99 g/mol |
| LogP | 3.96142 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.99353 |
| Heavy Atoms | 18 |
| Complexity | 557.4177 |
Chemical Identifiers
| CAS Number | 329777-80-2 |
|---|---|
| SMILES | CC1=CC(=CN=C1NC(=S)NC2=CC=CC=C2)Br |
Product Overview
N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea (CAS 329777-80-2), with molecular formula C13H12BrN3S and molecular weight 320.99 g/mol. IUPAC: 1-(5-bromo-3-methyl-2-pyridinyl)-3-phenylthiourea.
Chemical Property Profile of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea
Property Insights of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea
The XLogP value of 3.96142 indicates that N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.95 Ų, N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea has 2 hydrogen bond donor(s) and 2 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-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea?
The CAS number of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea is 329777-80-2.
What is the molecular formula of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea?
The molecular formula of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea is C13H12BrN3S.
What is the molecular weight of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea?
The molecular weight of N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea is 320.99 g/mol.
Where can I buy N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea?
You can request a quote for N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(5-bromo-3-methyl-2-pyridinyl)-N'-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.