7840-2895 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide

7840-2895 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide
7840-2895 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7840-2895
N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide

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

7840-2895

Molecular Formula

C22H13Cl2N3OS (C22 H13 Cl2 N3 OS)

Compound Name

N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide

IUPAC name

N-[3-(1H-13-benzodiazol-2-yl)phenyl]-36-dichloro-1-benzothiophene-2-carboxamide

SMILES

O=C(c(sc1c2ccc(Cl)c1)c2Cl)Nc1cc(-c2nc(cccc3)c3[nH]2)ccc1

InChI

InChI=1S/C22H13Cl2N3OS/c23-13-8-9-15-18(11-13)29-20(19(15)24)22(28)25-14-5-3-4-12(10-14)21-26-16-6-1-2-7-17(16)27-21/h1-11H,(H,25,28)(H,26,27)

InChI Key

SITNIHQLQQPZCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04163136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.117

Distribution Coefficient, logD

7.116

Water Solubility, LogSw

-6.76

Polar Surface Area

43.096

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

7840-2895 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7840-2895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7840-2895?
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What is the minimum amount of 7840-2895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7840-2895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7840-2895
  • 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 7840-2895 available by request