4340-1715 Screening compound: 2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid

4340-1715 Screening compound: 2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid
4340-1715 Screening compound: 2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4340-1715
2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid

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

4340-1715

Molecular Formula

C15H11BrN2O7S3 (C15 H11 BrN2 O7 S3)

Compound Name

2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid

IUPAC name

2-{5-bromo-2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-3-(2-sulfoethyl)-13-thiazolidin-5-ylidene]-23-dihydro-1H-indol-1-yl}acetic acid

SMILES

OC(CN(c(ccc(Br)c1)c1/C1=C(\C(N2CCS(O)(=O)=O)=O)/SC2=S)C1=O)=O

InChI

InChI=1S/C15H11BrN2O7S3/c16-7-1-2-9-8(5-7)11(13(21)18(9)6-10(19)20)12-14(22)17(15(26)27-12)3-4-28(23,24)25/h1-2,5H,3-4,6H2,(H,19,20)(H,23,24,25)

InChI Key

VGQIVMGOIPMHDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02992316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.36

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.861

Distribution Coefficient, logD

-10.179

Water Solubility, LogSw

-2.23

Polar Surface Area

103.876

Acid Dissociation Constant (pKa)

-1.92

Base Dissociation Constant (pKb)

-4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 4340-1715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4340-1715?
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What is the minimum amount of 4340-1715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4340-1715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4340-1715
  • 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 4340-1715 available by request