S697-2123 Screening compound: (4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidino)(6-methyl-3-pyridyl)methanone

S697-2123 Screening compound: (4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidino)(6-methyl-3-pyridyl)methanone
S697-2123 Screening compound: (4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidino)(6-methyl-3-pyridyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound S697-2123
(4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidino)(6-methyl-3-pyridyl)methanone

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

S697-2123

Molecular Formula

C19H26N4O2 (C19 H26 N4 O2)

Compound Name

(4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidino)(6-methyl-3-pyridyl)methanone

IUPAC name

5-(4-{[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]methyl}piperidine-1-carbonyl)-2-methylpyridine

SMILES

Cc1cnc(COC)n1CC(CC1)CCN1C(c1cnc(C)cc1)=O

InChI

InChI=1S/C19H26N4O2/c1-14-4-5-17(11-20-14)19(24)22-8-6-16(7-9-22)12-23-15(2)10-21-18(23)13-25-3/h4-5,10-11,16H,6-9,12-13H2,1-3H3

InChI Key

ZNVPIBHTBWVLFT-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.44

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

1.480

Distribution Coefficient, logD

0.929

Water Solubility, LogSw

-1.58

Polar Surface Area

46.415

Acid Dissociation Constant (pKa)

24.61

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.63

S697-2123 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with S697-2123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S697-2123?
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What is the minimum amount of S697-2123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S697-2123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S697-2123
  • 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 S697-2123 available by request