S697-1449 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine

S697-1449 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine
S697-1449 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S697-1449
4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine

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

S697-1449

Molecular Formula

C19H25N3O2 (C19 H25 N3 O2)

Compound Name

4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine

IUPAC name

4-[(25-dimethyl-1H-imidazol-1-yl)methyl]-1-(4-methoxybenzoyl)piperidine

SMILES

Cc1cnc(C)n1CC(CC1)CCN1C(c(cc1)ccc1OC)=O

InChI

InChI=1S/C19H25N3O2/c1-14-12-20-15(2)22(14)13-16-8-10-21(11-9-16)19(23)17-4-6-18(24-3)7-5-17/h4-7,12,16H,8-11,13H2,1-3H3

InChI Key

DMLKWGUTEGLEKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31997233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.43

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

2.371

Distribution Coefficient, logD

1.456

Water Solubility, LogSw

-2.24

Polar Surface Area

36.392

Acid Dissociation Constant (pKa)

24.61

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.37

S697-1449 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 S697-1449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S697-1449?
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What is the minimum amount of S697-1449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S697-1449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S697-1449
  • 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 S697-1449 available by request