3126-2438 Screening compound: 2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-2,3-dihydro-1H-indol-3-ylidene]acetohydrazide

3126-2438 Screening compound: 2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-2,3-dihydro-1H-indol-3-ylidene]acetohydrazide
3126-2438 Screening compound: 2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-2,3-dihydro-1H-indol-3-ylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3126-2438
2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-2,3-dihydro-1H-indol-3-ylidene]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

3126-2438

Molecular Formula

C22H22ClN5O3 (C22 H22 ClN5 O3)

Compound Name

2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-2,3-dihydro-1H-indol-3-ylidene]acetohydrazide

IUPAC name

2-{[(E)-[(2-chlorophenyl)methylidene]amino]oxy}-N'-[(3Z)-2-oxo-1-[(pyrrolidin-1-yl)methyl]-23-dihydro-1H-indol-3-ylidene]acetohydrazide

SMILES

O=C(CO/N=C/c(cccc1)c1Cl)N/N=C(/c(cccc1)c1N1CN2CCCC2)\C1=O

InChI

InChI=1S/C22H22ClN5O3/c23-18-9-3-1-7-16(18)13-24-31-14-20(29)25-26-21-17-8-2-4-10-19(17)28(22(21)30)15-27-11-5-6-12-27/h1-4,7-10,13H,5-6,11-12,14-15H2,(H,25,29)

InChI Key

KTICSSZRQCTMJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02641685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.9

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.561

Distribution Coefficient, logD

2.678

Water Solubility, LogSw

-3.88

Polar Surface Area

72.540

Acid Dissociation Constant (pKa)

9.72

Base Dissociation Constant (pKb)

8.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

3126-2438 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3126-2438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3126-2438?
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What is the minimum amount of 3126-2438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3126-2438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3126-2438
  • 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 3126-2438 available by request