1-(4-Bromophenyl)-3-methylthiourea
TL;DR: 1-(4-Bromophenyl)-3-methylthiourea (CAS 61449-55-6) is a chemical compound with molecular formula C8H9BrN2S and molecular weight 243.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-3-methylthiourea
Also Known As: 1-(4-bromophenyl)-3-methylthiourea, N-(4-bromophenyl)-N'-methylthiourea, N-(p-bromophenyl)-N'-methylthiourea, 1-(4-bromophenyl)-3-methyl-thiourea, Thiourea, N-(4-bromophenyl)-N'-methyl-
| Molecular Formula | C8H9BrN2S |
|---|---|
| Molecular Weight | 243.97 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.96698 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 61449-55-6 |
|---|---|
| SMILES | CNC(=S)NC1=CC=C(C=C1)Br |
| InChIKey | RMHOFVOPHVEJKQ-UHFFFAOYSA-N |
Product Overview
1-(4-Bromophenyl)-3-methylthiourea (CAS 61449-55-6), with molecular formula C8H9BrN2S and molecular weight 243.97 g/mol. IUPAC: 1-(4-bromophenyl)-3-methylthiourea.
Chemical Property Profile of 1-(4-Bromophenyl)-3-methylthiourea
Property Insights of 1-(4-Bromophenyl)-3-methylthiourea
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromophenyl)-3-methylthiourea. With a topological polar surface area (TPSA) of 56.2 Ų, 1-(4-Bromophenyl)-3-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-3-methylthiourea has 2 hydrogen bond donor(s) and 1 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 1-(4-Bromophenyl)-3-methylthiourea?
The CAS number of 1-(4-Bromophenyl)-3-methylthiourea is 61449-55-6.
What is the molecular formula of 1-(4-Bromophenyl)-3-methylthiourea?
The molecular formula of 1-(4-Bromophenyl)-3-methylthiourea is C8H9BrN2S.
What is the molecular weight of 1-(4-Bromophenyl)-3-methylthiourea?
The molecular weight of 1-(4-Bromophenyl)-3-methylthiourea is 243.97 g/mol.
Where can I buy 1-(4-Bromophenyl)-3-methylthiourea?
You can request a quote for 1-(4-Bromophenyl)-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenyl)-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.