C797-1632 Screening compound: 1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine

C797-1632 Screening compound: 1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine
C797-1632 Screening compound: 1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1632
1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine

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

C797-1632

Molecular Formula

C27H27FN4OS (C27 H27 FN4 OS)

Compound Name

1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine

IUPAC name

1-{4-[(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)methyl]benzoyl}-3-methylpiperidine

SMILES

CC(CCC1)CN1C(c1ccc(Cn2c(SCc(cc3)ccc3F)nc3c2nccc3)cc1)=O

InChI

InChI=1S/C27H27FN4OS/c1-19-4-3-15-31(16-19)26(33)22-10-6-20(7-11-22)17-32-25-24(5-2-14-29-25)30-27(32)34-18-21-8-12-23(28)13-9-21/h2,5-14,19H,3-4,15-18H2,1H3/t19-/m0/s1

InChI Key

IHHARJZUUVDLAH-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14798830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.805

Distribution Coefficient, logD

4.804

Water Solubility, LogSw

-4.49

Polar Surface Area

36.966

Acid Dissociation Constant (pKa)

19.27

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

C797-1632 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C797-1632 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C797-1632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1632
  • 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 C797-1632 available by request