1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea
TL;DR: 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea (CAS 6939-79-3) is a chemical compound with molecular formula C15H16N4S and molecular weight 284.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylanilino)-3-(3-methylphenyl)iminothiourea
Also Known As: NCIOpen2_002299, 1-(3-methylanilino)-3-(3-methylphenyl)iminothiourea, 1,5-Bis(3-methylphenyl)thiocarbazone, J3.167.677K, 3-[(3-methylphenyl)amino]-1-(3-methylphenyl)imino-thiourea
| Molecular Formula | C15H16N4S |
|---|---|
| Molecular Weight | 284.11 g/mol |
| LogP | 4.28874 |
| Topological Polar Surface Area | 48.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.10956 |
| Heavy Atoms | 20 |
| Complexity | 637.2756 |
Chemical Identifiers
| CAS Number | 6939-79-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NNC(=S)N=NC2=CC=CC(=C2)C |
Product Overview
1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea (CAS 6939-79-3), with molecular formula C15H16N4S and molecular weight 284.11 g/mol. IUPAC: 1-(3-methylanilino)-3-(3-methylphenyl)iminothiourea.
Chemical Property Profile of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea
Property Insights of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea
The XLogP value of 4.28874 indicates that 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.78 Ų, 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea 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 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea?
The CAS number of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea is 6939-79-3.
What is the molecular formula of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea?
The molecular formula of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea is C15H16N4S.
What is the molecular weight of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea?
The molecular weight of 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea is 284.11 g/mol.
Where can I buy 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea?
You can request a quote for 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methylanilino)-3-(3-methylphenyl)iminothiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.