P093-0952 Screening compound: N-(4-fluorobenzyl)-N-(4-methoxyphenyl)-1,6-indolinedicarboxamide

P093-0952 Screening compound: N-(4-fluorobenzyl)-N-(4-methoxyphenyl)-1,6-indolinedicarboxamide
P093-0952 Screening compound: N-(4-fluorobenzyl)-N-(4-methoxyphenyl)-1,6-indolinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P093-0952
N-(4-fluorobenzyl)-N-(4-methoxyphenyl)-1,6-indolinedicarboxamide

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

P093-0952

Molecular Formula

C24H22FN3O3 (C24 H22 FN3 O3)

Compound Name

N-(4-fluorobenzyl)-N-(4-methoxyphenyl)-1,6-indolinedicarboxamide

IUPAC name

N6-[(4-fluorophenyl)methyl]-N1-(4-methoxyphenyl)-23-dihydro-1H-indole-16-dicarboxamide

SMILES

COc(cc1)ccc1NC(N(CC1)c2c1ccc(C(NCc(cc1)ccc1F)=O)c2)=O

InChI

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

InChI Key

DSJIDPLBSVLICR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.062

Distribution Coefficient, logD

4.062

Water Solubility, LogSw

-4.18

Polar Surface Area

56.695

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

P093-0952 in Drug Discovery

Included in Screening Libraries

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

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P093-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P093-0952?
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What is the minimum amount of P093-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P093-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P093-0952
  • 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 P093-0952 available by request