1682-2038 Screening compound: 3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

1682-2038 Screening compound: 3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
1682-2038 Screening compound: 3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-2038
3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

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

1682-2038

Molecular Formula

C19H16ClN3O2S2 (C19 H16 ClN3 O2 S2)

Compound Name

3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

IUPAC name

3-chloro-N-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-13-thiazolidin-3-yl]benzamide

SMILES

CN(C)c1ccc(/C=C(/C(N2NC(c3cccc(Cl)c3)=O)=O)\SC2=S)cc1

InChI

InChI=1S/C19H16ClN3O2S2/c1-22(2)15-8-6-12(7-9-15)10-16-18(25)23(19(26)27-16)21-17(24)13-4-3-5-14(20)11-13/h3-11H,1-2H3,(H,21,24)

InChI Key

WGPADDOYDPUHBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00583880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.94

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.929

Distribution Coefficient, logD

3.761

Water Solubility, LogSw

-4.57

Polar Surface Area

45.648

Acid Dissociation Constant (pKa)

7.73

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 1682-2038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-2038?
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What is the minimum amount of 1682-2038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-2038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-2038
  • 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 1682-2038 available by request