P188-1459 Screening compound: 2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide

P188-1459 Screening compound: 2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide
P188-1459 Screening compound: 2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P188-1459
2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide

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

P188-1459

Molecular Formula

C24H22FN3O3 (C24 H22 FN3 O3)

Compound Name

2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H,6H,7H-pyrrolo[2,3-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide

IUPAC name

2-{1-[(3-fluorophenyl)methyl]-7-oxo-1H6H7H-pyrrolo[23-c]pyridin-6-yl}-N-[(4-methoxyphenyl)methyl]acetamide

SMILES

COc1ccc(CNC(CN(C=Cc2c3n(Cc4cccc(F)c4)cc2)C3=O)=O)cc1

InChI

InChI=1S/C24H22FN3O3/c1-31-21-7-5-17(6-8-21)14-26-22(29)16-28-12-10-19-9-11-27(23(19)24(28)30)15-18-3-2-4-20(25)13-18/h2-13H,14-16H2,1H3,(H,26,29)

InChI Key

OAELMHZYZJCVKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27568942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.678

Distribution Coefficient, logD

2.678

Water Solubility, LogSw

-2.98

Polar Surface Area

49.673

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

-2.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

P188-1459 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P188-1459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P188-1459?
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What is the minimum amount of P188-1459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P188-1459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P188-1459
  • 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 P188-1459 available by request