2049-2177 Screening compound: (2Z,5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one

2049-2177 Screening compound: (2Z,5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
2049-2177 Screening compound: (2Z,5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2049-2177
(2Z,5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)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

2049-2177

Molecular Formula

C28H29N3OS (C28 H29 N3 OS)

Compound Name

(2Z,5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one

IUPAC name

(2Z5Z)-5-{[4-(diethylamino)phenyl]methylidene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-13-thiazolidin-4-one

SMILES

CCN(CC)c1ccc(/C=C(/C(N2c3ccc(C)cc3)=O)\S/C2=N\c2ccc(C)cc2)cc1

InChI

InChI=1S/C28H29N3OS/c1-5-30(6-2)24-17-11-22(12-18-24)19-26-27(32)31(25-15-9-21(4)10-16-25)28(33-26)29-23-13-7-20(3)8-14-23/h7-19H,5-6H2,1-4H3

InChI Key

AIWVSGHQBSPAEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01064468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.62

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.761

Distribution Coefficient, logD

6.759

Water Solubility, LogSw

-5.71

Polar Surface Area

26.989

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

8.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

2049-2177 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 2049-2177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2049-2177?
Check Price and Availability of 2049-2177, 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 2049-2177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2049-2177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2049-2177
  • 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 2049-2177 available by request