6250-0004 Screening compound: 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea

6250-0004 Screening compound: 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea
6250-0004 Screening compound: 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 6250-0004
1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6250-0004

Molecular Formula

C9H8N4OS (C9 H8 N4 OS)

Compound Name

1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea

IUPAC name

1-phenyl-3-(123-thiadiazol-5-yl)urea

SMILES

O=C(Nc1cnns1)Nc1ccccc1

InChI

InChI=1S/C9H8N4OS/c14-9(12-8-6-10-13-15-8)11-7-4-2-1-3-5-7/h1-6H,(H2,11,12,14)

InChI Key

HFCYZXMHUIHAQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00078723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.817

Distribution Coefficient, logD

1.816

Water Solubility, LogSw

-2.25

Polar Surface Area

54.811

Acid Dissociation Constant (pKa)

10.20

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

6250-0004 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS targets activity set (6557 compounds)

Fragments Library (11262 compounds)

Human Receptors Annotated Library (5376 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6250-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6250-0004?
Check Price and Availability of 6250-0004, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6250-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6250-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6250-0004
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6250-0004 available by request