S606-0934 Screening compound: (3R)-N-(4-fluorobenzyl)-3-(1-methyl-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl)tetrahydro-1H-pyrrole-1-carboxamide

S606-0934 Screening compound: (3R)-N-(4-fluorobenzyl)-3-(1-methyl-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl)tetrahydro-1H-pyrrole-1-carboxamide
S606-0934 Screening compound: (3R)-N-(4-fluorobenzyl)-3-(1-methyl-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl)tetrahydro-1H-pyrrole-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S606-0934
(3R)-N-(4-fluorobenzyl)-3-(1-methyl-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl)tetrahydro-1H-pyrrole-1-carboxamide

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

S606-0934

Molecular Formula

C19H20FN5O2 (C19 H20 FN5 O2)

Compound Name

(3R)-N-(4-fluorobenzyl)-3-(1-methyl-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl)tetrahydro-1H-pyrrole-1-carboxamide

IUPAC name

(3R)-N-[(4-fluorophenyl)methyl]-3-{1-methyl-2-oxo-1H2H3H-imidazo[45-b]pyridin-3-yl}pyrrolidine-1-carboxamide

SMILES

CN(c1cccnc1N1[C@H](CC2)CN2C(NCc(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C19H20FN5O2/c1-23-16-3-2-9-21-17(16)25(19(23)27)15-8-10-24(12-15)18(26)22-11-13-4-6-14(20)7-5-13/h2-7,9,15H,8,10-12H2,1H3,(H,22,26)/t15-/m0/s1

InChI Key

KMIOXIGPHRGQNX-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.738

Distribution Coefficient, logD

1.738

Water Solubility, LogSw

-1.91

Polar Surface Area

54.337

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.58

S606-0934 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S606-0934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S606-0934?
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What is the minimum amount of S606-0934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S606-0934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S606-0934
  • 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 S606-0934 available by request