1037-1152 Screening compound: 2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

1037-1152 Screening compound: 2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione
1037-1152 Screening compound: 2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1037-1152
2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

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

1037-1152

Molecular Formula

C20H16N2O7 (C20 H16 N2 O7)

Compound Name

2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-(2-hydroxyethyl)-5-{[2-(2-hydroxyethyl)-13-dioxo-23-dihydro-1H-isoindol-5-yl]oxy}-23-dihydro-1H-isoindole-13-dione

SMILES

OCCN(C(c(cc1)c2cc1Oc(cc1)cc(C(N3CCO)=O)c1C3=O)=O)C2=O

InChI

InChI=1S/C20H16N2O7/c23-7-5-21-17(25)13-3-1-11(9-15(13)19(21)27)29-12-2-4-14-16(10-12)20(28)22(6-8-24)18(14)26/h1-4,9-10,23-24H,5-8H2

InChI Key

VVLFUCAJJOFCCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00334673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.36

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.696

Distribution Coefficient, logD

0.696

Water Solubility, LogSw

-2.15

Polar Surface Area

99.303

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

-6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1037-1152 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 1037-1152 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1037-1152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1037-1152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1037-1152
  • 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 1037-1152 available by request