8010-2211 Screening compound: N-[(1Z)-1-(1H-1,3-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide

8010-2211 Screening compound: N-[(1Z)-1-(1H-1,3-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide
8010-2211 Screening compound: N-[(1Z)-1-(1H-1,3-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-2211
N-[(1Z)-1-(1H-1,3-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide

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

8010-2211

Molecular Formula

C22H15BrClN3O (C22 H15 BrClN3 O)

Compound Name

N-[(1Z)-1-(1H-1,3-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide

IUPAC name

N-[(1Z)-1-(1H-13-benzodiazol-2-yl)-2-(4-bromophenyl)ethenyl]-2-chlorobenzamide

SMILES

O=C(c(cccc1)c1Cl)N/C(/c1nc(cccc2)c2[nH]1)=C\c(cc1)ccc1Br

InChI

InChI=1S/C22H15BrClN3O/c23-15-11-9-14(10-12-15)13-20(21-25-18-7-3-4-8-19(18)26-21)27-22(28)16-5-1-2-6-17(16)24/h1-13H,(H,25,26)(H,27,28)

InChI Key

OBKWDKUOYYFAAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00839362

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.74

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.827

Distribution Coefficient, logD

5.621

Water Solubility, LogSw

-6.02

Polar Surface Area

41.182

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8010-2211 in Drug Discovery

Included in Screening Libraries

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

Serine Proteases Inhibitors Library (32732 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8010-2211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-2211?
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What is the minimum amount of 8010-2211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-2211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-2211
  • 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 8010-2211 available by request