1900-3009 Screening compound: 3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one

1900-3009 Screening compound: 3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one
1900-3009 Screening compound: 3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1900-3009
3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one

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

1900-3009

Molecular Formula

C22H20N2O3S2 (C22 H20 N2 O3 S2)

Compound Name

3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one

IUPAC name

3-[(5Z)-3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-13-thiazolidin-5-ylidene]-1-propyl-23-dihydro-1H-indol-2-one

SMILES

CCCN(c(cccc1)c1/C1=C(\C(N2c(cc3)ccc3OCC)=O)/SC2=S)C1=O

InChI

InChI=1S/C22H20N2O3S2/c1-3-13-23-17-8-6-5-7-16(17)18(20(23)25)19-21(26)24(22(28)29-19)14-9-11-15(12-10-14)27-4-2/h5-12H,3-4,13H2,1-2H3

InChI Key

GFDYDWWRDQEFCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01072646

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.365

Distribution Coefficient, logD

4.365

Water Solubility, LogSw

-4.24

Polar Surface Area

38.673

Acid Dissociation Constant (pKa)

27.04

Base Dissociation Constant (pKb)

-0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

1900-3009 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1900-3009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1900-3009?
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What is the minimum amount of 1900-3009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1900-3009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1900-3009
  • 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 1900-3009 available by request