7646-2718 Screening compound: 6-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

7646-2718 Screening compound: 6-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione
7646-2718 Screening compound: 6-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 7646-2718
6-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-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

7646-2718

Molecular Formula

C21H13N3O2S (C21 H13 N3 O2 S)

Compound Name

6-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

IUPAC name

6-[4-(6-methyl-13-benzothiazol-2-yl)phenyl]-5H6H7H-pyrrolo[34-b]pyridine-57-dione

SMILES

Cc(cc1)cc2c1nc(-c(cc1)ccc1N(C(c1c3nccc1)=O)C3=O)s2

InChI

InChI=1S/C21H13N3O2S/c1-12-4-9-16-17(11-12)27-19(23-16)13-5-7-14(8-6-13)24-20(25)15-3-2-10-22-18(15)21(24)26/h2-11H,1H3

InChI Key

BCQXOGBAQZYEMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03680358

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.315

Distribution Coefficient, logD

3.315

Water Solubility, LogSw

-3.59

Polar Surface Area

48.238

Acid Dissociation Constant (pKa)

27.11

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

7646-2718 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 7646-2718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7646-2718?
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What is the minimum amount of 7646-2718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7646-2718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7646-2718
  • 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 7646-2718 available by request