S606-1375 Screening compound: (3R)-3-[1-(cyclohexylmethyl)-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl]-N-cyclopentyltetrahydro-1H-pyrrole-1-carboxamide

S606-1375 Screening compound: (3R)-3-[1-(cyclohexylmethyl)-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl]-N-cyclopentyltetrahydro-1H-pyrrole-1-carboxamide
S606-1375 Screening compound: (3R)-3-[1-(cyclohexylmethyl)-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl]-N-cyclopentyltetrahydro-1H-pyrrole-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S606-1375
(3R)-3-[1-(cyclohexylmethyl)-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl]-N-cyclopentyltetrahydro-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

S606-1375

Molecular Formula

C23H33N5O2 (C23 H33 N5 O2)

Compound Name

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

IUPAC name

(3R)-3-[1-(cyclohexylmethyl)-2-oxo-1H2H3H-imidazo[45-b]pyridin-3-yl]-N-cyclopentylpyrrolidine-1-carboxamide

SMILES

O=C(NC1CCCC1)N(CC1)C[C@@H]1N(c(nccc1)c1N1CC2CCCCC2)C1=O

InChI

InChI=1S/C23H33N5O2/c29-22(25-18-9-4-5-10-18)26-14-12-19(16-26)28-21-20(11-6-13-24-21)27(23(28)30)15-17-7-2-1-3-8-17/h6,11,13,17-19H,1-5,7-10,12,14-16H2,(H,25,29)/t19-/m1/s1

InChI Key

RBILAGCUHPTNIW-LJQANCHMSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.517

Distribution Coefficient, logD

4.517

Water Solubility, LogSw

-4.33

Polar Surface Area

54.583

Acid Dissociation Constant (pKa)

17.65

Base Dissociation Constant (pKb)

2.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

69.57

S606-1375 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 S606-1375 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S606-1375?
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What is the minimum amount of S606-1375 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S606-1375
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S606-1375
  • 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 S606-1375 available by request