P088-0960 Screening compound: N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-2,3-dihydro-1H-indole-1,4-dicarboxamide

P088-0960 Screening compound: N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-2,3-dihydro-1H-indole-1,4-dicarboxamide
P088-0960 Screening compound: N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-2,3-dihydro-1H-indole-1,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P088-0960
N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-2,3-dihydro-1H-indole-1,4-dicarboxamide

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

P088-0960

Molecular Formula

C25H33N5O2 (C25 H33 N5 O2)

Compound Name

N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-2,3-dihydro-1H-indole-1,4-dicarboxamide

IUPAC name

N4-[2-(4-ethylpiperazin-1-yl)ethyl]-N1-(3-methylphenyl)-23-dihydro-1H-indole-14-dicarboxamide

SMILES

CCN1CCN(CCNC(c2cccc3c2CCN3C(Nc2cc(C)ccc2)=O)=O)CC1

InChI

InChI=1S/C25H33N5O2/c1-3-28-14-16-29(17-15-28)13-11-26-24(31)22-8-5-9-23-21(22)10-12-30(23)25(32)27-20-7-4-6-19(2)18-20/h4-9,18H,3,10-17H2,1-2H3,(H,26,31)(H,27,32)

InChI Key

KZLSOVABHISXTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.064

Distribution Coefficient, logD

2.272

Water Solubility, LogSw

-3.53

Polar Surface Area

56.512

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

P088-0960 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P088-0960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P088-0960?
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What is the minimum amount of P088-0960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P088-0960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P088-0960
  • 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 P088-0960 available by request