K784-5144 Screening compound: 3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-1-(2,4,6-trimethylphenyl)thiourea

K784-5144 Screening compound: 3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-1-(2,4,6-trimethylphenyl)thiourea
K784-5144 Screening compound: 3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-1-(2,4,6-trimethylphenyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-5144
3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-1-(2,4,6-trimethylphenyl)thiourea

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

K784-5144

Molecular Formula

C29H30ClN5O4S2 (C29 H30 ClN5 O4 S2)

Compound Name

3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]amino}-1-(2,4,6-trimethylphenyl)thiourea

IUPAC name

3-{[(3Z)-1-[(4-chlorophenyl)methyl]-5-(morpholine-4-sulfonyl)-2-oxo-23-dihydro-1H-indol-3-ylidene]amino}-1-(246-trimethylphenyl)thiourea

SMILES

Cc(cc1C)cc(C)c1NC(N/N=C(/c(cc(cc1)S(N2CCOCC2)(=O)=O)c1N1Cc(cc2)ccc2Cl)\C1=O)=S

InChI

InChI=1S/C29H30ClN5O4S2/c1-18-14-19(2)26(20(3)15-18)31-29(40)33-32-27-24-16-23(41(37,38)34-10-12-39-13-11-34)8-9-25(24)35(28(27)36)17-21-4-6-22(30)7-5-21/h4-9,14-16H,10-13,17H2,1-3H3,(H2,31,33,40)

InChI Key

MFTHRHAYMZXMLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03451365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

612.17

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.590

Distribution Coefficient, logD

5.589

Water Solubility, LogSw

-5.80

Polar Surface Area

83.545

Acid Dissociation Constant (pKa)

10.15

Base Dissociation Constant (pKb)

-3.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

K784-5144 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K784-5144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-5144?
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What is the minimum amount of K784-5144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-5144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-5144
  • 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 K784-5144 available by request