8007-6530 Screening compound: 2,2'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(1,3-dioxo-{N}-1,3-thiazol-2-ylisoindoline-5-carboxamide)

8007-6530 Screening compound: 2,2'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(1,3-dioxo-{N}-1,3-thiazol-2-ylisoindoline-5-carboxamide)
8007-6530 Screening compound: 2,2'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(1,3-dioxo-{N}-1,3-thiazol-2-ylisoindoline-5-carboxamide) alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-6530
2,2'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(1,3-dioxo-{N}-1,3-thiazol-2-ylisoindoline-5-carboxamide)

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

8007-6530

Molecular Formula

C38H24N6O6S2 (C38 H24 N6 O6 S2)

Compound Name

2,2'-(3,3'-dimethylbiphenyl-4,4'-diyl)bis(1,3-dioxo-{N}-1,3-thiazol-2-ylisoindoline-5-carboxamide)

IUPAC name

2-(4'-{13-dioxo-5-[(13-thiazol-2-yl)carbamoyl]-23-dihydro-1H-isoindol-2-yl}-33'-dimethyl-[11'-biphenyl]-4-yl)-13-dioxo-N-(13-thiazol-2-yl)-23-dihydro-1H-isoindole-5-carboxamide

SMILES

Cc(cc(cc1)-c(cc2)cc(C)c2N(C(c(cc2)c3cc2C(Nc2nccs2)=O)=O)C3=O)c1N(C(c(cc1)c2cc1C(Nc1nccs1)=O)=O)C2=O

InChI

InChI=1S/C38H24N6O6S2/c1-19-15-21(5-9-29(19)43-33(47)25-7-3-23(17-27(25)35(43)49)31(45)41-37-39-11-13-51-37)22-6-10-30(20(2)16-22)44-34(48)26-8-4-24(18-28(26)36(44)50)32(46)42-38-40-12-14-52-38/h3-18H,1-2H3,(H,39,41,45)(H,40,42,46)

InChI Key

RMQMSJOZNPHFMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00779623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

724.78

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

6.993

Distribution Coefficient, logD

6.811

Water Solubility, LogSw

-5.67

Polar Surface Area

123.787

Acid Dissociation Constant (pKa)

7.68

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.26

References: we are preparing a list of scientific research reports with 8007-6530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-6530?
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What is the minimum amount of 8007-6530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-6530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-6530
  • 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 8007-6530 available by request