1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea
TL;DR: 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea (CAS 429628-13-7) is a chemical compound with molecular formula C13H16N4OS and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea
Also Known As: BAS 04866246, 1-(3,4-dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea, AB00110685-01, 1-(3,4-Dimethyl-phenyl)-3-(5-ethyl-[1,3,4]thiadiazol-2-yl)-urea, 1-(3,4-dimethylphenyl)-3-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
| Molecular Formula | C13H16N4OS |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 3.36134 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.1045 |
| Heavy Atoms | 19 |
| Complexity | 594.0792 |
Chemical Identifiers
| CAS Number | 429628-13-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)NC2=CC(=C(C=C2)C)C |
Product Overview
1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea (CAS 429628-13-7), with molecular formula C13H16N4OS and molecular weight 276.10 g/mol. IUPAC: 1-(3,4-dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea.
Chemical Property Profile of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea
Property Insights of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea
The XLogP value of 3.36134 indicates that 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea. Following Lipinski's Rule of Five, 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea has 2 hydrogen bond donor(s) and 4 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-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea?
The CAS number of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea is 429628-13-7.
What is the molecular formula of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea?
The molecular formula of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea is C13H16N4OS.
What is the molecular weight of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea?
The molecular weight of 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea is 276.10 g/mol.
Where can I buy 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea?
You can request a quote for 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethylphenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.