Y040-3292 Screening compound: 5-[(2,4-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazol-3-yl]phenol

Y040-3292 Screening compound: 5-[(2,4-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazol-3-yl]phenol
Y040-3292 Screening compound: 5-[(2,4-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazol-3-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-3292
5-[(2,4-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazol-3-yl]phenol

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

Y040-3292

Molecular Formula

C22H19Cl2N3O2S (C22 H19 Cl2 N3 O2 S)

Compound Name

5-[(2,4-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-1,3-thiazol-2-yl)-1H-pyrazol-3-yl]phenol

IUPAC name

5-[(24-dichlorophenyl)methoxy]-4-ethyl-2-[4-(4-methyl-13-thiazol-2-yl)-1H-pyrazol-3-yl]phenol

SMILES

CCc(cc(-c1n[nH]cc1-c1nc(C)cs1)c(O)c1)c1OCc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C22H19Cl2N3O2S/c1-3-13-6-16(21-17(9-25-27-21)22-26-12(2)11-30-22)19(28)8-20(13)29-10-14-4-5-15(23)7-18(14)24/h4-9,11,28H,3,10H2,1-2H3,(H,25,27)

InChI Key

NKAAQUYVFCFTST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01945325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.924

Distribution Coefficient, logD

6.922

Water Solubility, LogSw

-6.13

Polar Surface Area

57.831

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

Y040-3292 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 Y040-3292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-3292?
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What is the minimum amount of Y040-3292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-3292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-3292
  • 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 Y040-3292 available by request