5141-0464 Screening compound: (5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-1,3-thiazolidin-4-one

5141-0464 Screening compound: (5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-1,3-thiazolidin-4-one
5141-0464 Screening compound: (5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5141-0464
(5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-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

5141-0464

Molecular Formula

C20H20N4O3S (C20 H20 N4 O3 S)

Compound Name

(5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-1,3-thiazolidin-4-one

IUPAC name

(5E)-3-acetyl-2-imino-5-{[7-methyl-2-(morpholin-4-yl)quinolin-3-yl]methylidene}-13-thiazolidin-4-one

SMILES

CC(N(C(/C(/S1)=C\c2cc3ccc(C)cc3nc2N2CCOCC2)=O)C1=N)=O

InChI

InChI=1S/C20H20N4O3S/c1-12-3-4-14-10-15(11-17-19(26)24(13(2)25)20(21)28-17)18(22-16(14)9-12)23-5-7-27-8-6-23/h3-4,9-11,21H,5-8H2,1-2H3

InChI Key

BPVWEPRDBDAFCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03698238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.522

Distribution Coefficient, logD

2.522

Water Solubility, LogSw

-2.98

Polar Surface Area

66.929

Acid Dissociation Constant (pKa)

21.49

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

5141-0464 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5141-0464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5141-0464?
Check Price and Availability of 5141-0464, 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 5141-0464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5141-0464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5141-0464
  • 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 5141-0464 available by request