4476-2308 Screening compound: 3-[(5Z)-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one

4476-2308 Screening compound: 3-[(5Z)-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-2,3-dihydro-1H-indol-2-one
4476-2308 Screening compound: 3-[(5Z)-3-(2-methylpropyl)-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 4476-2308
3-[(5Z)-3-(2-methylpropyl)-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

4476-2308

Molecular Formula

C18H20N2O2S2 (C18 H20 N2 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

CCCN(c(cccc1)c1/C1=C(\C(N2CC(C)C)=O)/SC2=S)C1=O

InChI

InChI=1S/C18H20N2O2S2/c1-4-9-19-13-8-6-5-7-12(13)14(16(19)21)15-17(22)20(10-11(2)3)18(23)24-15/h5-8,11H,4,9-10H2,1-3H3

InChI Key

VAJIYVNNHYQNKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03461211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.111

Distribution Coefficient, logD

4.111

Water Solubility, LogSw

-4.15

Polar Surface Area

32.433

Acid Dissociation Constant (pKa)

25.60

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

References: we are preparing a list of scientific research reports with 4476-2308 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4476-2308?
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What is the minimum amount of 4476-2308 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4476-2308
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4476-2308
  • 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 4476-2308 available by request