4341-3255 Screening compound: (5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

4341-3255 Screening compound: (5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
4341-3255 Screening compound: (5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4341-3255
(5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-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

4341-3255

Molecular Formula

C28H22N6O2S (C28 H22 N6 O2 S)

Compound Name

(5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

IUPAC name

(5Z)-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-(pyridin-3-yl)-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

CCCOc(cc1)ccc1-c(c(/C=C1\Sc2nc(-c3cnccc3)nn2C1=O)c1)nn1-c1ccccc1

InChI

InChI=1S/C28H22N6O2S/c1-2-15-36-23-12-10-19(11-13-23)25-21(18-33(31-25)22-8-4-3-5-9-22)16-24-27(35)34-28(37-24)30-26(32-34)20-7-6-14-29-17-20/h3-14,16-18H,2,15H2,1H3

InChI Key

UDXQOTPTVPIFHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02998845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.166

Distribution Coefficient, logD

5.099

Water Solubility, LogSw

-4.80

Polar Surface Area

68.764

Acid Dissociation Constant (pKa)

27.49

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.70

References: we are preparing a list of scientific research reports with 4341-3255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4341-3255?
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What is the minimum amount of 4341-3255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4341-3255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4341-3255
  • 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 4341-3255 available by request