2322-1990 Screening compound: 3-(adamantan-1-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

2322-1990 Screening compound: 3-(adamantan-1-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide
2322-1990 Screening compound: 3-(adamantan-1-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2322-1990
3-(adamantan-1-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

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

2322-1990

Molecular Formula

C21H22Cl2N4O (C21 H22 Cl2 N4 O)

Compound Name

3-(adamantan-1-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

IUPAC name

3-(adamantan-1-yl)-N'-[(E)-(24-dichlorophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

SMILES

O=C(c1cc(C2(CC(C3)C4)CC4CC3C2)n[nH]1)N/N=C/c(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C21H22Cl2N4O/c22-16-2-1-15(17(23)6-16)11-24-27-20(28)18-7-19(26-25-18)21-8-12-3-13(9-21)5-14(4-12)10-21/h1-2,6-7,11-14H,3-5,8-10H2,(H,25,26)(H,27,28)

InChI Key

MQYBBUSRKDICPP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.34

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

6.846

Distribution Coefficient, logD

6.832

Water Solubility, LogSw

-6.62

Polar Surface Area

58.077

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

1.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

2322-1990 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 2322-1990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2322-1990?
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What is the minimum amount of 2322-1990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2322-1990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2322-1990
  • 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 2322-1990 available by request