1548-0673 Screening compound: 2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide

1548-0673 Screening compound: 2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide
1548-0673 Screening compound: 2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1548-0673
2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide

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

1548-0673

Molecular Formula

C20H17BrClN5O2 (C20 H17 BrClN5 O2)

Compound Name

2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide

IUPAC name

2-bromo-N-({N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbonyl}methyl)benzamide

SMILES

Cc(c(/C=N/NC(CNC(c(cccc1)c1Br)=O)=O)c1Cl)nn1-c1ccccc1

InChI

InChI=1S/C20H17BrClN5O2/c1-13-16(19(22)27(26-13)14-7-3-2-4-8-14)11-24-25-18(28)12-23-20(29)15-9-5-6-10-17(15)21/h2-11H,12H2,1H3,(H,23,29)(H,25,28)

InChI Key

IZSFEUFVMVEELK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00341528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.74

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.840

Distribution Coefficient, logD

3.834

Water Solubility, LogSw

-4.31

Polar Surface Area

74.825

Acid Dissociation Constant (pKa)

9.27

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

1548-0673 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1548-0673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1548-0673?
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What is the minimum amount of 1548-0673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1548-0673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1548-0673
  • 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 1548-0673 available by request