E989-0214 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}-4-oxobutanamide

E989-0214 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}-4-oxobutanamide
E989-0214 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E989-0214
N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}-4-oxobutanamide

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

E989-0214

Molecular Formula

C25H35ClN6O2 (C25 H35 ClN6 O2)

Compound Name

N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}-4-oxobutanamide

IUPAC name

N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-4-{2-methyl-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl}-4-oxobutanamide

SMILES

Cc1nn(CCCN2C(CCC(NCCCN(CC3)CCN3c3c(C)ccc(Cl)c3)=O)=O)c2c1

InChI

InChI=1S/C25H35ClN6O2/c1-19-5-6-21(26)18-22(19)30-15-13-29(14-16-30)10-3-9-27-23(33)7-8-25(34)31-11-4-12-32-24(31)17-20(2)28-32/h5-6,17-18H,3-4,7-16H2,1-2H3,(H,27,33)

InChI Key

YEYSQFAVQUBRLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14936325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.04

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.193

Distribution Coefficient, logD

0.992

Water Solubility, LogSw

-3.23

Polar Surface Area

58.759

Acid Dissociation Constant (pKa)

15.45

Base Dissociation Constant (pKb)

8.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

E989-0214 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E989-0214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E989-0214?
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What is the minimum amount of E989-0214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E989-0214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E989-0214
  • 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 E989-0214 available by request