8013-5348 Screening compound: N'~1~-[2,5-dioxo-1-(4-propoxyphenyl)tetrahydro-1H-pyrrol-3-yl]-2-hydroxybenzohydrazide

8013-5348 Screening compound: N'~1~-[2,5-dioxo-1-(4-propoxyphenyl)tetrahydro-1H-pyrrol-3-yl]-2-hydroxybenzohydrazide
8013-5348 Screening compound: N'~1~-[2,5-dioxo-1-(4-propoxyphenyl)tetrahydro-1H-pyrrol-3-yl]-2-hydroxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-5348
N'~1~-[2,5-dioxo-1-(4-propoxyphenyl)tetrahydro-1H-pyrrol-3-yl]-2-hydroxybenzohydrazide

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

8013-5348

Molecular Formula

C20H21N3O5 (C20 H21 N3 O5)

Compound Name

N'~1~-[2,5-dioxo-1-(4-propoxyphenyl)tetrahydro-1H-pyrrol-3-yl]-2-hydroxybenzohydrazide

IUPAC name

N'-[25-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-2-hydroxybenzohydrazide

SMILES

CCCOc(cc1)ccc1N(C(CC1NNC(c(cccc2)c2O)=O)=O)C1=O

InChI

InChI=1S/C20H21N3O5/c1-2-11-28-14-9-7-13(8-10-14)23-18(25)12-16(20(23)27)21-22-19(26)15-5-3-4-6-17(15)24/h3-10,16,21,24H,2,11-12H2,1H3,(H,22,26)/t16-/m0/s1

InChI Key

VTJIVJXXHJPGSJ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD03453728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.994

Distribution Coefficient, logD

1.979

Water Solubility, LogSw

-2.74

Polar Surface Area

91.658

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 8013-5348 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-5348?
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What is the minimum amount of 8013-5348 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-5348
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-5348
  • 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 8013-5348 available by request