K072-0246 Screening compound: methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

K072-0246 Screening compound: methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate
K072-0246 Screening compound: methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K072-0246
methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

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

K072-0246

Molecular Formula

C15H13N3O2S (C15 H13 N3 O2 S)

Compound Name

methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

IUPAC name

methyl 3-[(2E)-2-[(1H-indol-3-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

SMILES

COC(c(scc1)c1N/N=C/c1c[nH]c2c1cccc2)=O

InChI

InChI=1S/C15H13N3O2S/c1-20-15(19)14-13(6-7-21-14)18-17-9-10-8-16-12-5-3-2-4-11(10)12/h2-9,16,18H,1H3

InChI Key

MJRGTILOYNDXDS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.720

Distribution Coefficient, logD

3.720

Water Solubility, LogSw

-4.14

Polar Surface Area

52.741

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

K072-0246 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K072-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K072-0246?
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What is the minimum amount of K072-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K072-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K072-0246
  • 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 K072-0246 available by request