1770-0338 Screening compound: N-{2-[2-(4-bromophenyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]ethyl}-N,N-diethylamine

1770-0338 Screening compound: N-{2-[2-(4-bromophenyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]ethyl}-N,N-diethylamine
1770-0338 Screening compound: N-{2-[2-(4-bromophenyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]ethyl}-N,N-diethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1770-0338
N-{2-[2-(4-bromophenyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]ethyl}-N,N-diethylamine

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

1770-0338

Molecular Formula

C21H23BrN4 (C21 H23 BrN4)

Compound Name

N-{2-[2-(4-bromophenyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]ethyl}-N,N-diethylamine

IUPAC name

{2-[4-(4-bromophenyl)-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(8)36911-pentaen-5-yl]ethyl}diethylamine

SMILES

CCN(CC)CCn1c2nc(cccc3)c3n2cc1-c(cc1)ccc1Br

InChI

InChI=1S/C21H23BrN4/c1-3-24(4-2)13-14-25-20(16-9-11-17(22)12-10-16)15-26-19-8-6-5-7-18(19)23-21(25)26/h5-12,15H,3-4,13-14H2,1-2H3

InChI Key

MCDCVPRMAOPUCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01855636

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

411.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.413

Distribution Coefficient, logD

4.494

Water Solubility, LogSw

-5.51

Polar Surface Area

14.420

Acid Dissociation Constant (pKa)

22.40

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

1770-0338 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1770-0338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1770-0338?
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What is the minimum amount of 1770-0338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1770-0338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1770-0338
  • 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 1770-0338 available by request