![N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea structure](/static/products/4296/429623-89-2.webp)
N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea
TL;DR: N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea (CAS 429623-89-2) is a chemical compound with molecular formula C17H15BrN4OS and molecular weight 402.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dimethylphenyl)urea
Also Known As: AO-022/41291544, N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea, 1-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dimethylphenyl)urea, 1-(5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea, 1-[(2E)-5-(2-bromophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dimethylphenyl)urea
| Molecular Formula | C17H15BrN4OS |
|---|---|
| Molecular Weight | 402.01 g/mol |
| LogP | 5.22844 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.01498 |
| Heavy Atoms | 24 |
| Complexity | 893.802 |
Chemical Identifiers
| CAS Number | 429623-89-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)C3=CC=CC=C3Br)C |
Product Overview
N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea (CAS 429623-89-2), with molecular formula C17H15BrN4OS and molecular weight 402.01 g/mol. IUPAC: 1-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dimethylphenyl)urea.
Chemical Property Profile of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea
Property Insights of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea
The XLogP value of 5.22844 indicates that N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)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 N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea. Following Lipinski's Rule of Five, N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea?
The CAS number of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea is 429623-89-2.
What is the molecular formula of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea?
The molecular formula of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea is C17H15BrN4OS.
What is the molecular weight of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea?
The molecular weight of N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea is 402.01 g/mol.
Where can I buy N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea?
You can request a quote for N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(2-bromophenyl)-1,3,4-thiadiazol-2-yl]-N'-(3,4-dimethylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.