4708-0247 Screening compound: 11-(1H-imidazol-1-yl)-7,8,9,10-tetrahydro[1,3]benzimidazo[1,2-b]isoquinolin-6-yl cyanide

4708-0247 Screening compound: 11-(1H-imidazol-1-yl)-7,8,9,10-tetrahydro[1,3]benzimidazo[1,2-b]isoquinolin-6-yl cyanide
4708-0247 Screening compound: 11-(1H-imidazol-1-yl)-7,8,9,10-tetrahydro[1,3]benzimidazo[1,2-b]isoquinolin-6-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4708-0247
11-(1H-imidazol-1-yl)-7,8,9,10-tetrahydro[1,3]benzimidazo[1,2-b]isoquinolin-6-yl cyanide

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

4708-0247

Molecular Formula

C19H15N5 (C19 H15 N5)

Compound Name

11-(1H-imidazol-1-yl)-7,8,9,10-tetrahydro[1,3]benzimidazo[1,2-b]isoquinolin-6-yl cyanide

IUPAC name

9-(1H-imidazol-1-yl)-1017-diazatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-1(17)2811(16)1214-hexaene-2-carbonitrile

SMILES

N#Cc1c(CCCC2)c2c(-n2cncc2)n2c1nc1c2cccc1

InChI

InChI=1S/C19H15N5/c20-11-15-13-5-1-2-6-14(13)19(23-10-9-21-12-23)24-17-8-4-3-7-16(17)22-18(15)24/h3-4,7-10,12H,1-2,5-6H2

InChI Key

PILVSMGIETVYJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02366924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.178

Distribution Coefficient, logD

3.177

Water Solubility, LogSw

-2.98

Polar Surface Area

41.388

Acid Dissociation Constant (pKa)

27.53

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

4708-0247 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4708-0247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4708-0247?
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What is the minimum amount of 4708-0247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4708-0247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4708-0247
  • 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 4708-0247 available by request