S697-1479 Screening compound: 1-{4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one

S697-1479 Screening compound: 1-{4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one
S697-1479 Screening compound: 1-{4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S697-1479
1-{4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-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

S697-1479

Molecular Formula

C18H24N4O (C18 H24 N4 O)

Compound Name

1-{4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one

IUPAC name

1-{4-[(25-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one

SMILES

Cc1cnc(C)n1CC(CC1)CCN1C(Cc1cnccc1)=O

InChI

InChI=1S/C18H24N4O/c1-14-11-20-15(2)22(14)13-16-5-8-21(9-6-16)18(23)10-17-4-3-7-19-12-17/h3-4,7,11-12,16H,5-6,8-10,13H2,1-2H3

InChI Key

QNQTZJURHFZJKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32226013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.41

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

1.380

Distribution Coefficient, logD

0.465

Water Solubility, LogSw

-0.67

Polar Surface Area

37.839

Acid Dissociation Constant (pKa)

15.34

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

S697-1479 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 S697-1479 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of S697-1479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S697-1479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S697-1479
  • 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 S697-1479 available by request