3657-1253 Screening compound: (5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione

3657-1253 Screening compound: (5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione
3657-1253 Screening compound: (5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3657-1253
(5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-1,3-thiazolidine-2,4-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

3657-1253

Molecular Formula

C16H18N2O2S (C16 H18 N2 O2 S)

Compound Name

(5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione

IUPAC name

(5Z)-3-methyl-5-{[4-(piperidin-1-yl)phenyl]methylidene}-13-thiazolidine-24-dione

SMILES

CN(C(/C(/S1)=C/c(cc2)ccc2N2CCCCC2)=O)C1=O

InChI

InChI=1S/C16H18N2O2S/c1-17-15(19)14(21-16(17)20)11-12-5-7-13(8-6-12)18-9-3-2-4-10-18/h5-8,11H,2-4,9-10H2,1H3

InChI Key

HOVYTZNPZVUMKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02623991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.312

Distribution Coefficient, logD

3.312

Water Solubility, LogSw

-3.56

Polar Surface Area

33.085

Acid Dissociation Constant (pKa)

27.56

Base Dissociation Constant (pKb)

8.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with 3657-1253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3657-1253?
Check Price and Availability of 3657-1253, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3657-1253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3657-1253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3657-1253
  • 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 3657-1253 available by request