K072-0182 Screening compound: methyl 3-[(2E)-2-[(5-bromothiophen-2-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

K072-0182 Screening compound: methyl 3-[(2E)-2-[(5-bromothiophen-2-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate
K072-0182 Screening compound: methyl 3-[(2E)-2-[(5-bromothiophen-2-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K072-0182
methyl 3-[(2E)-2-[(5-bromothiophen-2-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

K072-0182

Molecular Formula

C11H9BrN2O2S2 (C11 H9 BrN2 O2 S2)

Compound Name

methyl 3-[(2E)-2-[(5-bromothiophen-2-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

IUPAC name

methyl 3-[(2E)-2-[(5-bromothiophen-2-yl)methylidene]hydrazin-1-yl]thiophene-2-carboxylate

SMILES

COC(c(scc1)c1N/N=C/c(s1)ccc1Br)=O

InChI

InChI=1S/C11H9BrN2O2S2/c1-16-11(15)10-8(4-5-17-10)14-13-6-7-2-3-9(12)18-7/h2-6,14H,1H3

InChI Key

NELSZZHODDERMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248745

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.152

Distribution Coefficient, logD

4.152

Water Solubility, LogSw

-4.24

Polar Surface Area

43.888

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

K072-0182 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with K072-0182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K072-0182?
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What is the minimum amount of K072-0182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K072-0182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K072-0182
  • 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 K072-0182 available by request