1127-1180 Screening compound: N-(6-bromo-1,3-benzothiazol-2-yl)-2,4-dichlorobenzamide

1127-1180 Screening compound: N-(6-bromo-1,3-benzothiazol-2-yl)-2,4-dichlorobenzamide
1127-1180 Screening compound: N-(6-bromo-1,3-benzothiazol-2-yl)-2,4-dichlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1127-1180
N-(6-bromo-1,3-benzothiazol-2-yl)-2,4-dichlorobenzamide

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

1127-1180

Molecular Formula

C14H7BrCl2N2OS (C14 H7 BrCl2 N2 OS)

Compound Name

N-(6-bromo-1,3-benzothiazol-2-yl)-2,4-dichlorobenzamide

IUPAC name

N-(6-bromo-13-benzothiazol-2-yl)-24-dichlorobenzamide

SMILES

O=C(c(ccc(Cl)c1)c1Cl)Nc1nc(ccc(Br)c2)c2s1

InChI

InChI=1S/C14H7BrCl2N2OS/c15-7-1-4-11-12(5-7)21-14(18-11)19-13(20)9-3-2-8(16)6-10(9)17/h1-6H,(H,18,19,20)

InChI Key

WGVGWWAIOWWCDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00689559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.1

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.792

Distribution Coefficient, logD

5.682

Water Solubility, LogSw

-6.11

Polar Surface Area

33.091

Acid Dissociation Constant (pKa)

7.94

Base Dissociation Constant (pKb)

-0.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1127-1180 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1127-1180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1127-1180?
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What is the minimum amount of 1127-1180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1127-1180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1127-1180
  • 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 1127-1180 available by request