8010-3609 Screening compound: (4E)-1-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-3-methyl-4,5-dihydro-1H-pyrazol-5-one

8010-3609 Screening compound: (4E)-1-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-3-methyl-4,5-dihydro-1H-pyrazol-5-one
8010-3609 Screening compound: (4E)-1-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-3-methyl-4,5-dihydro-1H-pyrazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3609
(4E)-1-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-3-methyl-4,5-dihydro-1H-pyrazol-5-one

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

8010-3609

Molecular Formula

C15H14BrN5OS (C15 H14 BrN5 OS)

Compound Name

(4E)-1-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-3-methyl-4,5-dihydro-1H-pyrazol-5-one

IUPAC name

(4E)-1-(4-bromophenyl)-4-{[(5-ethyl-134-thiadiazol-2-yl)amino]methylidene}-3-methyl-45-dihydro-1H-pyrazol-5-one

SMILES

CCc1nnc(N/C=C(\C(C)=NN2c(cc3)ccc3Br)/C2=O)s1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.559

Distribution Coefficient, logD

3.329

Water Solubility, LogSw

-3.68

Polar Surface Area

61.228

Acid Dissociation Constant (pKa)

7.56

Base Dissociation Constant (pKb)

-6.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8010-3609 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8010-3609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3609?
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What is the minimum amount of 8010-3609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3609
  • 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 8010-3609 available by request