8008-9763 Screening compound: N'~1~-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-yliden)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetohydrazide

8008-9763 Screening compound: N'~1~-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-yliden)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetohydrazide
8008-9763 Screening compound: N'~1~-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-yliden)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9763
N'~1~-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-yliden)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetohydrazide

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

8008-9763

Molecular Formula

C16H14BrN5O2S (C16 H14 BrN5 O2 S)

Compound Name

N'~1~-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-yliden)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetohydrazide

IUPAC name

N'-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-[(46-dimethylpyrimidin-2-yl)sulfanyl]acetohydrazide

SMILES

Cc1nc(SCC(N/N=C(\c(cc(cc2)Br)c2N2)/C2=O)=O)nc(C)c1

InChI

InChI=1S/C16H14BrN5O2S/c1-8-5-9(2)19-16(18-8)25-7-13(23)21-22-14-11-6-10(17)3-4-12(11)20-15(14)24/h3-6H,7H2,1-2H3,(H,21,23)(H,20,22,24)

InChI Key

DMXLWVLYFZXHJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.851

Distribution Coefficient, logD

2.818

Water Solubility, LogSw

-3.36

Polar Surface Area

76.057

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

References: we are preparing a list of scientific research reports with 8008-9763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9763?
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What is the minimum amount of 8008-9763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9763
  • 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 8008-9763 available by request