K784-4797 Screening compound: 1-(3-methoxyphenyl)-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

K784-4797 Screening compound: 1-(3-methoxyphenyl)-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
K784-4797 Screening compound: 1-(3-methoxyphenyl)-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 K784-4797
1-(3-methoxyphenyl)-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

K784-4797

Molecular Formula

C25H29N5O4S2 (C25 H29 N5 O4 S2)

Compound Name

1-(3-methoxyphenyl)-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-(3-methoxyphenyl)-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

CC(CC1)CCN1S(c(cc1)cc(/C2=N/NC(Nc3cc(OC)ccc3)=S)c1N(CC=C)C2=O)(=O)=O

InChI

InChI=1S/C25H29N5O4S2/c1-4-12-30-22-9-8-20(36(32,33)29-13-10-17(2)11-14-29)16-21(22)23(24(30)31)27-28-25(35)26-18-6-5-7-19(15-18)34-3/h4-9,15-17H,1,10-14H2,2-3H3,(H2,26,28,35)

InChI Key

KBDOYHYPNHTDNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03451204

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.67

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.828

Distribution Coefficient, logD

4.828

Water Solubility, LogSw

-4.48

Polar Surface Area

84.825

Acid Dissociation Constant (pKa)

11.53

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with K784-4797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-4797?
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What is the minimum amount of K784-4797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-4797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-4797
  • 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 K784-4797 available by request