E002-0752 Screening compound: 3-(cycloheptylamino)-2-[4-(propan-2-yloxy)phenyl]-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile

E002-0752 Screening compound: 3-(cycloheptylamino)-2-[4-(propan-2-yloxy)phenyl]-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile
E002-0752 Screening compound: 3-(cycloheptylamino)-2-[4-(propan-2-yloxy)phenyl]-1H-pyrazolo[1,5-a]imidazole-7-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-0752
3-(cycloheptylamino)-2-[4-(propan-2-yloxy)phenyl]-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

E002-0752

Molecular Formula

C22H27N5O (C22 H27 N5 O)

Compound Name

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

IUPAC name

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

SMILES

CC(C)Oc(cc1)ccc1-c1c(NC2CCCCCC2)n2ncc(C#N)c2[nH]1

InChI

InChI=1S/C22H27N5O/c1-15(2)28-19-11-9-16(10-12-19)20-22(25-18-7-5-3-4-6-8-18)27-21(26-20)17(13-23)14-24-27/h9-12,14-15,18,25-26H,3-8H2,1-2H3

InChI Key

ORCVAEMSNIPIRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14834774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.854

Distribution Coefficient, logD

4.854

Water Solubility, LogSw

-4.39

Polar Surface Area

55.525

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

E002-0752 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with E002-0752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-0752?
Check Price and Availability of E002-0752, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E002-0752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-0752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-0752
  • 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 E002-0752 available by request