D351-2819 Screening compound: 2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol

D351-2819 Screening compound: 2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol
D351-2819 Screening compound: 2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D351-2819
2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol

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

D351-2819

Molecular Formula

C22H24ClN5O3 (C22 H24 ClN5 O3)

Compound Name

2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol

IUPAC name

2-{4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-124-triazole-3-carbonyl]piperazin-1-yl}ethan-1-ol

SMILES

COc(cc1)ccc1-c1nc(C(N2CCN(CCO)CC2)=O)nn1-c(cccc1)c1Cl

InChI

InChI=1S/C22H24ClN5O3/c1-31-17-8-6-16(7-9-17)21-24-20(25-28(21)19-5-3-2-4-18(19)23)22(30)27-12-10-26(11-13-27)14-15-29/h2-9,29H,10-15H2,1H3

InChI Key

GWRYFUSHJZVQOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27581356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.92

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.861

Distribution Coefficient, logD

2.836

Water Solubility, LogSw

-3.41

Polar Surface Area

68.226

Acid Dissociation Constant (pKa)

14.97

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D351-2819 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D351-2819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D351-2819?
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What is the minimum amount of D351-2819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D351-2819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D351-2819
  • 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 D351-2819 available by request