1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea structure

1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea

TL;DR: 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea (CAS 570-85-4) is a chemical compound with molecular formula C15H11FN4OS and molecular weight 314.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea

Also Known As: KST-1B5732, BAS 00704369, BIM-0027515.P001, 1-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea, N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea

CAS: 570-85-4
Molecular Formula C15H11FN4OS
Molecular Weight 314.06 g/mol
LogP 3.9882
Topological Polar Surface Area 66.91 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 314.06375
Heavy Atoms 22
Complexity 773.7512

Chemical Identifiers

CAS Number 570-85-4
SMILES C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)F

Product Overview

1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea (CAS 570-85-4), with molecular formula C15H11FN4OS and molecular weight 314.06 g/mol. IUPAC: 1-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea

XLogP
3.9882
TPSA (Topological Polar Surface Area)
66.91
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
22
Complexity
773.7512
Exact Mass
314.06375
Monoisotopic Mass
314.06375
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea

The XLogP value of 3.9882 indicates that 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea 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-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea. Following Lipinski's Rule of Five, 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea 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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea?

The CAS number of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea is 570-85-4.

What is the molecular formula of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea?

The molecular formula of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea is C15H11FN4OS.

What is the molecular weight of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea?

The molecular weight of 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea is 314.06 g/mol.

Where can I buy 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea?

You can request a quote for 1-[5-(4-Fluorophenyl)-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-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea?

Yes, KEHONG BIO provides custom synthesis services for 1-[5-(4-Fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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