S692-1992 Screening compound: 1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one

S692-1992 Screening compound: 1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one
S692-1992 Screening compound: 1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S692-1992
1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-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

S692-1992

Molecular Formula

C21H30N4O2 (C21 H30 N4 O2)

Compound Name

1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one

IUPAC name

1-[3-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(35-dimethyl-12-oxazol-4-yl)propan-1-one

SMILES

Cc1cnc(C2CCC2)n1C(CCC1)CN1C(CCc1c(C)onc1C)=O

InChI

InChI=1S/C21H30N4O2/c1-14-12-22-21(17-6-4-7-17)25(14)18-8-5-11-24(13-18)20(26)10-9-19-15(2)23-27-16(19)3/h12,17-18H,4-11,13H2,1-3H3/t18-/m0/s1

InChI Key

ORRIGRRIXUUOJF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD31995997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.997

Distribution Coefficient, logD

-0.419

Water Solubility, LogSw

-1.83

Polar Surface Area

50.152

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

S692-1992 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with S692-1992 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S692-1992?
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What is the minimum amount of S692-1992 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S692-1992
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S692-1992
  • 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 S692-1992 available by request