N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea
TL;DR: N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea (CAS 100280-55-5) 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-(4-bromophenyl)-3-(5-methyl-2-pyridinyl)thiourea
Also Known As: 1-(4-bromophenyl)-3-(5-methylpyridin-2-yl)thiourea, N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea, N-(4-bromo-phenyl)-N'-(5-methyl-[2]pyridyl)-thiourea, 1-(4-Bromo-phenyl)-3-(5-methyl-pyridin-2-yl)-thiourea, N2-cyclopentyl-N4-(3-isobutoxypropyl)-6-methoxy-1,3,5-triazine-2,4-diamine
| 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 | 487.66776 |
Chemical Identifiers
| CAS Number | 100280-55-5 |
|---|---|
| SMILES | CC1=CN=C(C=C1)NC(=S)NC2=CC=C(C=C2)Br |
Product Overview
N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea (CAS 100280-55-5), with molecular formula C13H12BrN3S and molecular weight 320.99 g/mol. IUPAC: 1-(4-bromophenyl)-3-(5-methyl-2-pyridinyl)thiourea.
Chemical Property Profile of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea
Property Insights of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea
The XLogP value of 3.96142 indicates that N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea 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-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea 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-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea?
The CAS number of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea is 100280-55-5.
What is the molecular formula of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea?
The molecular formula of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea is C13H12BrN3S.
What is the molecular weight of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea?
The molecular weight of N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea is 320.99 g/mol.
Where can I buy N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea?
You can request a quote for N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)-N'-(5-methyl-2-pyridinyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.