C909-0490 Screening compound: 2-{[6,7-dimethoxy-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl}-5lambda~6~-thieno[3,2-c]thiochromene-5,5(4H)-dione

C909-0490 Screening compound: 2-{[6,7-dimethoxy-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl}-5lambda~6~-thieno[3,2-c]thiochromene-5,5(4H)-dione
C909-0490 Screening compound: 2-{[6,7-dimethoxy-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl}-5lambda~6~-thieno[3,2-c]thiochromene-5,5(4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0490
2-{[6,7-dimethoxy-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl}-5lambda~6~-thieno[3,2-c]thiochromene-5,5(4H)-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

C909-0490

Molecular Formula

C24H23NO5S2 (C24 H23 NO5 S2)

Compound Name

2-{[6,7-dimethoxy-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl}-5lambda~6~-thieno[3,2-c]thiochromene-5,5(4H)-dione

IUPAC name

2-(67-dimethoxy-1-methyl-1234-tetrahydroisoquinoline-2-carbonyl)-4H-5lambda6-thieno[32-c]thiochromene-55-dione

SMILES

CC(c(cc1OC)c(CC2)cc1OC)N2C(c1cc(CS(c2c-3cccc2)(=O)=O)c3s1)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.578

Distribution Coefficient, logD

3.578

Water Solubility, LogSw

-3.74

Polar Surface Area

60.178

Acid Dissociation Constant (pKa)

19.14

Base Dissociation Constant (pKb)

-2.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

C909-0490 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with C909-0490 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0490?
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What is the minimum amount of C909-0490 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0490
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0490
  • 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 C909-0490 available by request