1015-0028 Screening compound: (5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

1015-0028 Screening compound: (5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
1015-0028 Screening compound: (5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1015-0028
(5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)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

1015-0028

Molecular Formula

C19H18N2O4S (C19 H18 N2 O4 S)

Compound Name

(5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

IUPAC name

(5E)-3-{[(4-methoxyphenyl)amino]methyl}-5-[(2-methoxyphenyl)methylidene]-13-thiazolidine-24-dione

SMILES

COc(cc1)ccc1NCN(C(/C(/S1)=C\c(cccc2)c2OC)=O)C1=O

InChI

InChI=1S/C19H18N2O4S/c1-24-15-9-7-14(8-10-15)20-12-21-18(22)17(26-19(21)23)11-13-5-3-4-6-16(13)25-2/h3-11,20H,12H2,1-2H3

InChI Key

OVPHEONCIFQROP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00806843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.333

Distribution Coefficient, logD

4.333

Water Solubility, LogSw

-4.37

Polar Surface Area

55.929

Acid Dissociation Constant (pKa)

18.95

Base Dissociation Constant (pKb)

3.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

1015-0028 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 1015-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1015-0028?
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What is the minimum amount of 1015-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1015-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1015-0028
  • 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 1015-0028 available by request