4965-0037 Screening compound: 3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-2,3-dihydro-1H-indol-2-one

4965-0037 Screening compound: 3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-2,3-dihydro-1H-indol-2-one
4965-0037 Screening compound: 3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4965-0037
3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-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

4965-0037

Molecular Formula

C14H18N2O3 (C14 H18 N2 O3)

Compound Name

3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-2,3-dihydro-1H-indol-2-one

IUPAC name

3-hydroxy-3-[(2E)-2-(hydroxyimino)propyl]-1-propyl-23-dihydro-1H-indol-2-one

SMILES

CCCN(C(C1(C/C(/C)=N/O)O)=O)c2c1cccc2

InChI

InChI=1S/C14H18N2O3/c1-3-8-16-12-7-5-4-6-11(12)14(18,13(16)17)9-10(2)15-19/h4-7,18-19H,3,8-9H2,1-2H3/t14-/m0/s1

InChI Key

LHOARXIRVQWPPJ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD00484220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.373

Distribution Coefficient, logD

1.372

Water Solubility, LogSw

-2.17

Polar Surface Area

60.591

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

4965-0037 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 4965-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4965-0037?
Check Price and Availability of 4965-0037, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4965-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4965-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4965-0037
  • 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 4965-0037 available by request