2368-0652 Screening compound: (2Z,5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

2368-0652 Screening compound: (2Z,5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one
2368-0652 Screening compound: (2Z,5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2368-0652
(2Z,5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

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

2368-0652

Molecular Formula

C25H25N3OS (C25 H25 N3 OS)

Compound Name

(2Z,5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

IUPAC name

(2Z5E)-5-{[25-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(35-dimethylphenyl)imino]-13-thiazolidin-4-one

SMILES

Cc1cc(/C=C(\C(N2)=O)/S/C2=N\c2cc(C)cc(C)c2)c(C)n1-c1ccc(C)cc1

InChI

InChI=1S/C25H25N3OS/c1-15-6-8-22(9-7-15)28-18(4)13-20(19(28)5)14-23-24(29)27-25(30-23)26-21-11-16(2)10-17(3)12-21/h6-14H,1-5H3,(H,26,27,29)

InChI Key

QBASJMPBROYZJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01610705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.685

Distribution Coefficient, logD

5.685

Water Solubility, LogSw

-5.41

Polar Surface Area

35.817

Acid Dissociation Constant (pKa)

12.70

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 2368-0652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2368-0652?
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What is the minimum amount of 2368-0652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2368-0652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2368-0652
  • 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 2368-0652 available by request