2147-0099 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide

2147-0099 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide
2147-0099 Screening compound: N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2147-0099
N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide

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

2147-0099

Molecular Formula

C25H22BrN3O (C25 H22 BrN3 O)

Compound Name

N'-[(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide

IUPAC name

N'-[(E)-[1-(4-bromophenyl)-25-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(naphthalen-1-yl)acetohydrazide

SMILES

Cc1cc(/C=N/NC(Cc2cccc3ccccc23)=O)c(C)n1-c(cc1)ccc1Br

InChI

InChI=1S/C25H22BrN3O/c1-17-14-21(18(2)29(17)23-12-10-22(26)11-13-23)16-27-28-25(30)15-20-8-5-7-19-6-3-4-9-24(19)20/h3-14,16H,15H2,1-2H3,(H,28,30)

InChI Key

OEHCHTRMSSVION-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.051

Distribution Coefficient, logD

6.051

Water Solubility, LogSw

-6.70

Polar Surface Area

37.734

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

2147-0099 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 2147-0099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2147-0099?
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What is the minimum amount of 2147-0099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2147-0099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2147-0099
  • 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 2147-0099 available by request