K784-4809 Screening compound: 1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]amino}thiourea

K784-4809 Screening compound: 1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]amino}thiourea
K784-4809 Screening compound: 1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]amino}thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-4809
1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]amino}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

K784-4809

Molecular Formula

C26H31N5O3S2 (C26 H31 N5 O3 S2)

Compound Name

1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]amino}thiourea

IUPAC name

1-(4-ethylphenyl)-3-{[(3Z)-5-[(4-methylpiperidin-1-yl)sulfonyl]-2-oxo-1-(prop-2-en-1-yl)-23-dihydro-1H-indol-3-ylidene]amino}thiourea

SMILES

CCc(cc1)ccc1NC(N/N=C(/c(cc(cc1)S(N2CCC(C)CC2)(=O)=O)c1N1CC=C)\C1=O)=S

InChI

InChI=1S/C26H31N5O3S2/c1-4-14-31-23-11-10-21(36(33,34)30-15-12-18(3)13-16-30)17-22(23)24(25(31)32)28-29-26(35)27-20-8-6-19(5-2)7-9-20/h4,6-11,17-18H,1,5,12-16H2,2-3H3,(H2,27,29,35)

InChI Key

ULEGLZXGQWBGKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03451216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.7

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.692

Distribution Coefficient, logD

5.692

Water Solubility, LogSw

-5.37

Polar Surface Area

77.282

Acid Dissociation Constant (pKa)

11.23

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

K784-4809 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K784-4809 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-4809?
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What is the minimum amount of K784-4809 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-4809
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-4809
  • 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 K784-4809 available by request