3253-4516 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide

3253-4516 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide
3253-4516 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3253-4516
N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide

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

3253-4516

Molecular Formula

C22H14BrN5O2 (C22 H14 BrN5 O2)

Compound Name

N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide

IUPAC name

N'-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide

SMILES

O=C(c1cc(-c2cc3ccccc3cc2)n[nH]1)N/N=C(\c(cc(cc1)Br)c1N1)/C1=O

InChI

InChI=1S/C22H14BrN5O2/c23-15-7-8-17-16(10-15)20(22(30)24-17)27-28-21(29)19-11-18(25-26-19)14-6-5-12-3-1-2-4-13(12)9-14/h1-11H,(H,25,26)(H,28,29)(H,24,27,30)

InChI Key

ITZBKJSEBMQAPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01914234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.209

Distribution Coefficient, logD

5.099

Water Solubility, LogSw

-6.02

Polar Surface Area

81.582

Acid Dissociation Constant (pKa)

7.94

Base Dissociation Constant (pKb)

-0.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3253-4516 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3253-4516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3253-4516?
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What is the minimum amount of 3253-4516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3253-4516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3253-4516
  • 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 3253-4516 available by request