![1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea structure](/static/products/4489/448914-70-3.webp)
1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea
TL;DR: 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea (CAS 448914-70-3) is a chemical compound with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-1-prop-2-enyl-1-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)urea
Also Known As: BAS 04914401, AJ-292/41302843, A2873/0121078, 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea, 3-(4-methoxyphenyl)-1-prop-2-en-1-yl-1-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]urea
| Molecular Formula | C18H17N5O2S |
|---|---|
| Molecular Weight | 367.11 g/mol |
| LogP | 3.8332 |
| Topological Polar Surface Area | 80.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.1103 |
| Heavy Atoms | 26 |
| Complexity | 880.1118 |
Chemical Identifiers
| CAS Number | 448914-70-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)N(CC=C)C2=NN=C(S2)C3=CC=NC=C3 |
Product Overview
1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea (CAS 448914-70-3), with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol. IUPAC: 3-(4-methoxyphenyl)-1-prop-2-enyl-1-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)urea.
Chemical Property Profile of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea
Property Insights of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea
The XLogP value of 3.8332 indicates that 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea. Following Lipinski's Rule of Five, 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea has 1 hydrogen bond donor(s) and 6 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-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea?
The CAS number of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea is 448914-70-3.
What is the molecular formula of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea?
The molecular formula of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea is C18H17N5O2S.
What is the molecular weight of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea?
The molecular weight of 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea is 367.11 g/mol.
Where can I buy 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea?
You can request a quote for 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[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-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-3-(4-methoxy-phenyl)-1-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.