P937-3298 Screening compound: 3-[5-({1-[(2,3-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]pyridine

P937-3298 Screening compound: 3-[5-({1-[(2,3-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]pyridine
P937-3298 Screening compound: 3-[5-({1-[(2,3-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound P937-3298
3-[5-({1-[(2,3-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]pyridine

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

P937-3298

Molecular Formula

C21H25N5O2 (C21 H25 N5 O2)

Compound Name

3-[5-({1-[(2,3-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-1,2,4-triazol-3-yl]pyridine

IUPAC name

3-[5-({1-[(23-dimethoxyphenyl)methyl]pyrrolidin-3-yl}methyl)-4H-124-triazol-3-yl]pyridine

SMILES

COc(cccc1CN2CC(Cc3nnc(-c4cnccc4)[nH]3)CC2)c1OC

InChI

InChI=1S/C21H25N5O2/c1-27-18-7-3-5-17(20(18)28-2)14-26-10-8-15(13-26)11-19-23-21(25-24-19)16-6-4-9-22-12-16/h3-7,9,12,15H,8,10-11,13-14H2,1-2H3,(H,23,24,25)/t15-/m0/s1

InChI Key

YVZUBLZBLABEQR-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD31981823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.145

Distribution Coefficient, logD

-1.628

Water Solubility, LogSw

-1.97

Polar Surface Area

63.640

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

10.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

P937-3298 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P937-3298 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P937-3298?
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What is the minimum amount of P937-3298 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P937-3298
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P937-3298
  • 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 P937-3298 available by request