0242-0549 Screening compound: 2-(2-{10-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetyl]-1,7-dioxa-4,10-diazacyclododecan-4-yl}-2-oxoethyl)-2,3-dihydro-1H-isoindole-1,3-dione

0242-0549 Screening compound: 2-(2-{10-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetyl]-1,7-dioxa-4,10-diazacyclododecan-4-yl}-2-oxoethyl)-2,3-dihydro-1H-isoindole-1,3-dione
0242-0549 Screening compound: 2-(2-{10-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetyl]-1,7-dioxa-4,10-diazacyclododecan-4-yl}-2-oxoethyl)-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-0549
2-(2-{10-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetyl]-1,7-dioxa-4,10-diazacyclododecan-4-yl}-2-oxoethyl)-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

0242-0549

Molecular Formula

C28H28N4O8 (C28 H28 N4 O8)

Compound Name

2-(2-{10-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetyl]-1,7-dioxa-4,10-diazacyclododecan-4-yl}-2-oxoethyl)-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-(2-{10-[2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)acetyl]-17-dioxa-410-diazacyclododecan-4-yl}-2-oxoethyl)-23-dihydro-1H-isoindole-13-dione

SMILES

O=C(CN(C(c1c2cccc1)=O)C2=O)N(CCOCC1)CCOCCN1C(CN(C(c1c2cccc1)=O)C2=O)=O

InChI

InChI=1S/C28H28N4O8/c33-23(17-31-25(35)19-5-1-2-6-20(19)26(31)36)29-9-13-39-15-11-30(12-16-40-14-10-29)24(34)18-32-27(37)21-7-3-4-8-22(21)28(32)38/h1-8H,9-18H2

InChI Key

UCXNQBVYTNSIJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00319271

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

548.55

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

-0.124

Distribution Coefficient, logD

-0.124

Water Solubility, LogSw

-2.18

Polar Surface Area

107.485

Acid Dissociation Constant (pKa)

24.07

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with 0242-0549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-0549?
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What is the minimum amount of 0242-0549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-0549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-0549
  • 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 0242-0549 available by request