E002-0751 Screening compound: 2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile

E002-0751 Screening compound: 2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile
E002-0751 Screening compound: 2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-0751
2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile

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

E002-0751

Molecular Formula

C19H20BrN5 (C19 H20 BrN5)

Compound Name

2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile

IUPAC name

2-(4-bromophenyl)-3-(cycloheptylamino)-1H-pyrazolo[15-a]imidazole-7-carbonitrile

SMILES

N#Cc1c([nH]c(-c(cc2)ccc2Br)c2NC3CCCCCC3)n2nc1

InChI

InChI=1S/C19H20BrN5/c20-15-9-7-13(8-10-15)17-19(23-16-5-3-1-2-4-6-16)25-18(24-17)14(11-21)12-22-25/h7-10,12,16,23-24H,1-6H2

InChI Key

YXQNUDMREAWYRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14834773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.022

Distribution Coefficient, logD

5.022

Water Solubility, LogSw

-4.72

Polar Surface Area

48.722

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

E002-0751 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E002-0751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-0751?
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What is the minimum amount of E002-0751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-0751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-0751
  • 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 E002-0751 available by request