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N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea
TL;DR: N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea (CAS 65608-90-4) is a chemical compound with molecular formula C12H16N2S and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methylphenyl)methyl]-3-prop-2-enylthiourea
Also Known As: 1-[(4-methylphenyl)methyl]-3-prop-2-enylthiourea, AB00041958-01, N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea, N-[(4-Methylphenyl)methyl]-N'-(prop-2-en-1-yl)thiourea
| Molecular Formula | C12H16N2S |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 2.14512 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.10342 |
| Heavy Atoms | 15 |
| Complexity | 329.9803 |
Chemical Identifiers
| CAS Number | 65608-90-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=S)NCC=C |
Product Overview
N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea (CAS 65608-90-4), with molecular formula C12H16N2S and molecular weight 220.10 g/mol. IUPAC: 1-[(4-methylphenyl)methyl]-3-prop-2-enylthiourea.
Chemical Property Profile of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea
Property Insights of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea
The XLogP value of 2.14512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea. With a topological polar surface area (TPSA) of 24.06 Ų, N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea 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 N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea?
The CAS number of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea is 65608-90-4.
What is the molecular formula of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea?
The molecular formula of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea is C12H16N2S.
What is the molecular weight of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea?
The molecular weight of N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea is 220.10 g/mol.
Where can I buy N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea?
You can request a quote for N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-Methylphenyl)methyl]-N'-prop-2-en-1-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.