G889-1151 Screening compound: 5-[(3-METHYLBENZOYL)AMINO]-2-[4-(2-METHYL-3H-IMIDAZO[4,5-B]PYRIDIN-3-YL)PIPERIDINO]BENZOIC ACID

G889-1151 Screening compound: 5-[(3-METHYLBENZOYL)AMINO]-2-[4-(2-METHYL-3H-IMIDAZO[4,5-B]PYRIDIN-3-YL)PIPERIDINO]BENZOIC ACID
G889-1151 Screening compound: 5-[(3-METHYLBENZOYL)AMINO]-2-[4-(2-METHYL-3H-IMIDAZO[4,5-B]PYRIDIN-3-YL)PIPERIDINO]BENZOIC ACID alternative view

Chemical Structure Depiction of ChemDiv screening compound G889-1151
5-[(3-METHYLBENZOYL)AMINO]-2-[4-(2-METHYL-3H-IMIDAZO[4,5-B]PYRIDIN-3-YL)PIPERIDINO]BENZOIC ACID

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

G889-1151

Molecular Formula

C27H27N5O3 (C27 H27 N5 O3)

Compound Name

5-[(3-METHYLBENZOYL)AMINO]-2-[4-(2-METHYL-3H-IMIDAZO[4,5-B]PYRIDIN-3-YL)PIPERIDINO]BENZOIC ACID

IUPAC name

2-(4-{2-methyl-3H-imidazo[45-b]pyridin-3-yl}piperidin-1-yl)-5-(3-methylbenzamido)benzoic acid

SMILES

Cc1nc2cccnc2n1C(CC1)CCN1c(ccc(NC(c1cc(C)ccc1)=O)c1)c1C(O)=O

InChI

InChI=1S/C27H27N5O3/c1-17-5-3-6-19(15-17)26(33)30-20-8-9-24(22(16-20)27(34)35)31-13-10-21(11-14-31)32-18(2)29-23-7-4-12-28-25(23)32/h3-9,12,15-16,21H,10-11,13-14H2,1-2H3,(H,30,33)(H,34,35)

InChI Key

NYSYTDCJQCQMRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27166351

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

469.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.369

Distribution Coefficient, logD

2.118

Water Solubility, LogSw

-4.14

Polar Surface Area

75.886

Acid Dissociation Constant (pKa)

5.15

Base Dissociation Constant (pKb)

2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.93

G889-1151 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G889-1151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G889-1151?
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What is the minimum amount of G889-1151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G889-1151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G889-1151
  • 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 G889-1151 available by request