G942-0104 Screening compound: N-(2-bromo-4-methylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide

G942-0104 Screening compound: N-(2-bromo-4-methylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide
G942-0104 Screening compound: N-(2-bromo-4-methylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G942-0104
N-(2-bromo-4-methylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide

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

G942-0104

Molecular Formula

C19H18BrN3O3 (C19 H18 BrN3 O3)

Compound Name

N-(2-bromo-4-methylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide

IUPAC name

N-(2-bromo-4-methylphenyl)-2-(4-methyl-25-dioxo-2345-tetrahydro-1H-14-benzodiazepin-1-yl)acetamide

SMILES

Cc(cc1)cc(Br)c1NC(CN(c(cccc1)c1C(N(C)C1)=O)C1=O)=O

InChI

InChI=1S/C19H18BrN3O3/c1-12-7-8-15(14(20)9-12)21-17(24)10-23-16-6-4-3-5-13(16)19(26)22(2)11-18(23)25/h3-9H,10-11H2,1-2H3,(H,21,24)

InChI Key

BUIZAKIYAXGRKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15076504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.825

Distribution Coefficient, logD

1.825

Water Solubility, LogSw

-2.80

Polar Surface Area

54.748

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

G942-0104 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epigenetics Focused Set (26518 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G942-0104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G942-0104?
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What is the minimum amount of G942-0104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G942-0104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G942-0104
  • 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 G942-0104 available by request