4076-0315 Screening compound: 3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-1H-pyrazole-5-carbohydrazide

4076-0315 Screening compound: 3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-1H-pyrazole-5-carbohydrazide
4076-0315 Screening compound: 3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-1H-pyrazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4076-0315
3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)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

4076-0315

Molecular Formula

C24H25N5O2 (C24 H25 N5 O2)

Compound Name

3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-1H-pyrazole-5-carbohydrazide

IUPAC name

3-(4-butoxyphenyl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-1H-pyrazole-5-carbohydrazide

SMILES

CCCCOc(cc1)ccc1-c1n[nH]c(C(N/N=C/c2c(C)[nH]c3c2cccc3)=O)c1

InChI

InChI=1S/C24H25N5O2/c1-3-4-13-31-18-11-9-17(10-12-18)22-14-23(28-27-22)24(30)29-25-15-20-16(2)26-21-8-6-5-7-19(20)21/h5-12,14-15,26H,3-4,13H2,1-2H3,(H,27,28)(H,29,30)

InChI Key

XLIZCUDJBFQKDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02932170

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.013

Distribution Coefficient, logD

6.011

Water Solubility, LogSw

-5.62

Polar Surface Area

75.388

Acid Dissociation Constant (pKa)

9.70

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with 4076-0315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4076-0315?
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What is the minimum amount of 4076-0315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4076-0315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4076-0315
  • 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 4076-0315 available by request