![1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea structure](/static/products/489/489443-48-3.png)
1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea
TL;DR: 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea (CAS 489443-48-3) is a chemical compound with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea
Also Known As: BIM-0010442.P001, 1-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea, 1-phenyl-3-(5-((m-tolyloxy)methyl)-1,3,4-thiadiazol-2-yl)urea, 1-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea, N-{5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-N'-phenylurea
| Molecular Formula | C17H16N4O2S |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 4.06952 |
| Topological Polar Surface Area | 76.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.0994 |
| Heavy Atoms | 24 |
| Complexity | 820.2226 |
Chemical Identifiers
| CAS Number | 489443-48-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC2=NN=C(S2)NC(=O)NC3=CC=CC=C3 |
Product Overview
1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea (CAS 489443-48-3), with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol. IUPAC: 1-[5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea.
Chemical Property Profile of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea
Property Insights of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea
The XLogP value of 4.06952 indicates that 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea. Following Lipinski's Rule of Five, 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea has 2 hydrogen bond donor(s) and 5 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-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea?
The CAS number of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea is 489443-48-3.
What is the molecular formula of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea?
The molecular formula of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea is C17H16N4O2S.
What is the molecular weight of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea?
The molecular weight of 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea is 340.10 g/mol.
Where can I buy 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea?
You can request a quote for 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-{5-[(3-Methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.