P772-0077 Screening compound: 2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl 2-chloropropanoate

P772-0077 Screening compound: 2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl 2-chloropropanoate
P772-0077 Screening compound: 2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl 2-chloropropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P772-0077
2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl 2-chloropropanoate

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

P772-0077

Molecular Formula

C24H22ClN3O2 (C24 H22 ClN3 O2)

Compound Name

2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl 2-chloropropanoate

IUPAC name

2-[3-(benzylamino)-8-methylimidazo[12-a]pyridin-2-yl]phenyl 2-chloropropanoate

SMILES

CC(C(Oc(cccc1)c1-c1c(NCc2ccccc2)n(cccc2C)c2n1)=O)Cl

InChI

InChI=1S/C24H22ClN3O2/c1-16-9-8-14-28-22(16)27-21(23(28)26-15-18-10-4-3-5-11-18)19-12-6-7-13-20(19)30-24(29)17(2)25/h3-14,17,26H,15H2,1-2H3/t17-/m0/s1

InChI Key

FRJINFYNCYJJKN-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27614793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.876

Distribution Coefficient, logD

4.875

Water Solubility, LogSw

-4.54

Polar Surface Area

40.283

Acid Dissociation Constant (pKa)

17.21

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

P772-0077 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P772-0077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P772-0077?
Check Price and Availability of P772-0077, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P772-0077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P772-0077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P772-0077
  • 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 P772-0077 available by request