S698-2132 Screening compound: 1-[4-(2,5-dimethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

S698-2132 Screening compound: 1-[4-(2,5-dimethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one
S698-2132 Screening compound: 1-[4-(2,5-dimethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S698-2132
1-[4-(2,5-dimethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-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

S698-2132

Molecular Formula

C17H25N5O (C17 H25 N5 O)

Compound Name

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

IUPAC name

1-[4-(25-dimethyl-1H-imidazol-1-yl)piperidin-1-yl]-3-(4-methyl-1H-pyrazol-1-yl)propan-1-one

SMILES

Cc1cn(CCC(N(CC2)CCC2n2c(C)ncc2C)=O)nc1

InChI

InChI=1S/C17H25N5O/c1-13-10-19-21(12-13)9-6-17(23)20-7-4-16(5-8-20)22-14(2)11-18-15(22)3/h10-12,16H,4-9H2,1-3H3

InChI Key

XMEPCTGYYKPDFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31964066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.800

Distribution Coefficient, logD

-1.108

Water Solubility, LogSw

-1.06

Polar Surface Area

43.461

Acid Dissociation Constant (pKa)

22.82

Base Dissociation Constant (pKb)

9.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

S698-2132 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with S698-2132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S698-2132?
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What is the minimum amount of S698-2132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S698-2132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S698-2132
  • 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 S698-2132 available by request