S606-1323 Screening compound: 1-(cyclopropylmethyl)-3-[(3R)-1-(2-thienylmethyl)tetrahydro-1H-pyrrol-3-yl]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

S606-1323 Screening compound: 1-(cyclopropylmethyl)-3-[(3R)-1-(2-thienylmethyl)tetrahydro-1H-pyrrol-3-yl]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one
S606-1323 Screening compound: 1-(cyclopropylmethyl)-3-[(3R)-1-(2-thienylmethyl)tetrahydro-1H-pyrrol-3-yl]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S606-1323
1-(cyclopropylmethyl)-3-[(3R)-1-(2-thienylmethyl)tetrahydro-1H-pyrrol-3-yl]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-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

S606-1323

Molecular Formula

C19H22N4OS (C19 H22 N4 OS)

Compound Name

1-(cyclopropylmethyl)-3-[(3R)-1-(2-thienylmethyl)tetrahydro-1H-pyrrol-3-yl]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

IUPAC name

1-(cyclopropylmethyl)-3-[(3R)-1-[(thiophen-2-yl)methyl]pyrrolidin-3-yl]-1H2H3H-imidazo[45-b]pyridin-2-one

SMILES

O=C1N([C@H]2CN(Cc3cccs3)CC2)c2ncccc2N1CC1CC1

InChI

InChI=1S/C19H22N4OS/c24-19-22(11-14-5-6-14)17-4-1-8-20-18(17)23(19)15-7-9-21(12-15)13-16-3-2-10-25-16/h1-4,8,10,14-15H,5-7,9,11-13H2/t15-/m0/s1

InChI Key

WLMHBBUKXKTPCP-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.047

Distribution Coefficient, logD

1.812

Water Solubility, LogSw

-3.25

Polar Surface Area

32.782

Acid Dissociation Constant (pKa)

21.55

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.37

S606-1323 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 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 S606-1323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S606-1323?
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What is the minimum amount of S606-1323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S606-1323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S606-1323
  • 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 S606-1323 available by request