1464-0007 Screening compound: (5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-1,3-thiazolidine-2,4-dione

1464-0007 Screening compound: (5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-1,3-thiazolidine-2,4-dione
1464-0007 Screening compound: (5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1464-0007
(5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-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

1464-0007

Molecular Formula

C17H20N2O2S (C17 H20 N2 O2 S)

Compound Name

(5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-1,3-thiazolidine-2,4-dione

IUPAC name

(5E)-5-[(3-methylphenyl)methylidene]-3-[(piperidin-1-yl)methyl]-13-thiazolidine-24-dione

SMILES

Cc1cccc(/C=C(\C(N2CN3CCCCC3)=O)/SC2=O)c1

InChI

InChI=1S/C17H20N2O2S/c1-13-6-5-7-14(10-13)11-15-16(20)19(17(21)22-15)12-18-8-3-2-4-9-18/h5-7,10-11H,2-4,8-9,12H2,1H3

InChI Key

ZOFWZHBGTQVFBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01245777

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.915

Distribution Coefficient, logD

3.046

Water Solubility, LogSw

-3.76

Polar Surface Area

35.022

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

8.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

1464-0007 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 1464-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1464-0007?
Check Price and Availability of 1464-0007, 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 1464-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1464-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1464-0007
  • 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 1464-0007 available by request