3235-0029 Screening compound: (3Z)-3-[(2-bromophenyl)imino]-2,3-dihydro-1H-indol-2-one

3235-0029 Screening compound: (3Z)-3-[(2-bromophenyl)imino]-2,3-dihydro-1H-indol-2-one
3235-0029 Screening compound: (3Z)-3-[(2-bromophenyl)imino]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3235-0029
(3Z)-3-[(2-bromophenyl)imino]-2,3-dihydro-1H-indol-2-one

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

3235-0029

Molecular Formula

C14H9BrN2O (C14 H9 BrN2 O)

Compound Name

(3Z)-3-[(2-bromophenyl)imino]-2,3-dihydro-1H-indol-2-one

IUPAC name

(3Z)-3-[(2-bromophenyl)imino]-23-dihydro-1H-indol-2-one

SMILES

O=C1Nc(cccc2)c2/C1=N/c(cccc1)c1Br

InChI

InChI=1S/C14H9BrN2O/c15-10-6-2-4-8-12(10)16-13-9-5-1-3-7-11(9)17-14(13)18/h1-8H,(H,16,17,18)

InChI Key

AIHFMODGKKPMHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00297994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.14

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.982

Distribution Coefficient, logD

2.982

Water Solubility, LogSw

-3.76

Polar Surface Area

31.520

Acid Dissociation Constant (pKa)

14.31

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3235-0029 in Drug Discovery

Included in Screening Libraries

Crystallographic and 19F NMR fragment-libraries (624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3235-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3235-0029?
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What is the minimum amount of 3235-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3235-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3235-0029
  • 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 3235-0029 available by request