G812-0012 Screening compound: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[4,5-b]pyridin-2-yl]butan-1-one

G812-0012 Screening compound: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[4,5-b]pyridin-2-yl]butan-1-one
G812-0012 Screening compound: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[4,5-b]pyridin-2-yl]butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G812-0012
1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[4,5-b]pyridin-2-yl]butan-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

G812-0012

Molecular Formula

C25H32ClN5O (C25 H32 ClN5 O)

Compound Name

1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[4,5-b]pyridin-2-yl]butan-1-one

IUPAC name

1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[3-(3-methylbutyl)-3H-imidazo[45-b]pyridin-2-yl]butan-1-one

SMILES

CC(C)CCn1c(nccc2)c2nc1CCCC(N(CC1)CCN1c1cccc(Cl)c1)=O

InChI

InChI=1S/C25H32ClN5O/c1-19(2)11-13-31-23(28-22-8-5-12-27-25(22)31)9-4-10-24(32)30-16-14-29(15-17-30)21-7-3-6-20(26)18-21/h3,5-8,12,18-19H,4,9-11,13-17H2,1-2H3

InChI Key

VYPLCIUZCXWAJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15038375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.547

Distribution Coefficient, logD

4.547

Water Solubility, LogSw

-4.57

Polar Surface Area

40.681

Acid Dissociation Constant (pKa)

20.79

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

G812-0012 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 G812-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G812-0012?
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What is the minimum amount of G812-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G812-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G812-0012
  • 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 G812-0012 available by request