5756-0422 Screening compound: 1-{5-[(3Z)-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide

5756-0422 Screening compound: 1-{5-[(3Z)-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide
5756-0422 Screening compound: 1-{5-[(3Z)-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5756-0422
1-{5-[(3Z)-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide

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

5756-0422

Molecular Formula

C21H24N4O3S (C21 H24 N4 O3 S)

Compound Name

1-{5-[(3Z)-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperidine-4-carboxamide

IUPAC name

1-{5-[(3Z)-1-butyl-2-oxo-23-dihydro-1H-indol-3-ylidene]-4-oxo-45-dihydro-13-thiazol-2-yl}piperidine-4-carboxamide

SMILES

CCCCN(c(cccc1)c1/C1=C2/SC(N(CC3)CCC3C(N)=O)=NC2=O)C1=O

InChI

InChI=1S/C21H24N4O3S/c1-2-3-10-25-15-7-5-4-6-14(15)16(20(25)28)17-19(27)23-21(29-17)24-11-8-13(9-12-24)18(22)26/h4-7,13H,2-3,8-12H2,1H3,(H2,22,26)

InChI Key

FXAMWJMZSPQGJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03712765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.092

Distribution Coefficient, logD

2.092

Water Solubility, LogSw

-2.82

Polar Surface Area

75.373

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with 5756-0422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5756-0422?
Check Price and Availability of 5756-0422, 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 5756-0422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5756-0422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5756-0422
  • 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 5756-0422 available by request