1,3-Bis(3,4-dimethylphenyl)thiourea
TL;DR: 1,3-Bis(3,4-dimethylphenyl)thiourea (CAS 106537-74-0) is a chemical compound with molecular formula C17H20N2S and molecular weight 284.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(3,4-dimethylphenyl)thiourea
Also Known As: Maybridge1_000921, 1,3-bis(3,4-dimethylphenyl)thiourea, 1,3-Bis-(3,4-dimethyl-phenyl)-thiourea, J3.086.702E
| Molecular Formula | C17H20N2S |
|---|---|
| Molecular Weight | 284.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.1347 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 106537-74-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=S)NC2=CC(=C(C=C2)C)C)C |
| InChIKey | MUIABUGBWZVRME-UHFFFAOYSA-N |
Product Overview
1,3-Bis(3,4-dimethylphenyl)thiourea (CAS 106537-74-0), with molecular formula C17H20N2S and molecular weight 284.13 g/mol. IUPAC: 1,3-bis(3,4-dimethylphenyl)thiourea.
Chemical Property Profile of 1,3-Bis(3,4-dimethylphenyl)thiourea
Property Insights of 1,3-Bis(3,4-dimethylphenyl)thiourea
The XLogP value of 4.5 indicates that 1,3-Bis(3,4-dimethylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, 1,3-Bis(3,4-dimethylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(3,4-dimethylphenyl)thiourea 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 1,3-Bis(3,4-dimethylphenyl)thiourea?
The CAS number of 1,3-Bis(3,4-dimethylphenyl)thiourea is 106537-74-0.
What is the molecular formula of 1,3-Bis(3,4-dimethylphenyl)thiourea?
The molecular formula of 1,3-Bis(3,4-dimethylphenyl)thiourea is C17H20N2S.
What is the molecular weight of 1,3-Bis(3,4-dimethylphenyl)thiourea?
The molecular weight of 1,3-Bis(3,4-dimethylphenyl)thiourea is 284.13 g/mol.
Where can I buy 1,3-Bis(3,4-dimethylphenyl)thiourea?
You can request a quote for 1,3-Bis(3,4-dimethylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(3,4-dimethylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(3,4-dimethylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.