8007-7507 Screening compound: 2,6-bis(5-chloro-2-methylphenyl)-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

8007-7507 Screening compound: 2,6-bis(5-chloro-2-methylphenyl)-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
8007-7507 Screening compound: 2,6-bis(5-chloro-2-methylphenyl)-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-7507
2,6-bis(5-chloro-2-methylphenyl)-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

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

8007-7507

Molecular Formula

C24H14Cl2N2O4 (C24 H14 Cl2 N2 O4)

Compound Name

2,6-bis(5-chloro-2-methylphenyl)-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

IUPAC name

26-bis(5-chloro-2-methylphenyl)-1H2H3H5H6H7H-pyrrolo[34-f]isoindole-1357-tetrone

SMILES

Cc(ccc(Cl)c1)c1N(C(c(c1c2)cc(C(N3c4c(C)ccc(Cl)c4)=O)c2C3=O)=O)C1=O

InChI

InChI=1S/C24H14Cl2N2O4/c1-11-3-5-13(25)7-19(11)27-21(29)15-9-17-18(10-16(15)22(27)30)24(32)28(23(17)31)20-8-14(26)6-4-12(20)2/h3-10H,1-2H3

InChI Key

DUCHZUZRWJQTEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01204861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.843

Distribution Coefficient, logD

5.843

Water Solubility, LogSw

-5.94

Polar Surface Area

56.919

Acid Dissociation Constant (pKa)

28.33

Base Dissociation Constant (pKb)

-10.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

8007-7507 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8007-7507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-7507?
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What is the minimum amount of 8007-7507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-7507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-7507
  • 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 8007-7507 available by request