K000-0020 Screening compound: 3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methylidene]propanehydrazide

K000-0020 Screening compound: 3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methylidene]propanehydrazide
K000-0020 Screening compound: 3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K000-0020
3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methylidene]propanehydrazide

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

K000-0020

Molecular Formula

C27H36N4O2 (C27 H36 N4 O2)

Compound Name

3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(1,2-dimethyl-1H-1,3-benzodiazol-5-yl)methylidene]propanehydrazide

IUPAC name

3-(35-di-tert-butyl-4-hydroxyphenyl)-N'-[(E)-(12-dimethyl-1H-13-benzodiazol-5-yl)methylidene]propanehydrazide

SMILES

CC(C)(C)c1cc(CCC(N/N=C/c(cc2)cc3c2n(C)c(C)n3)=O)cc(C(C)(C)C)c1O

InChI

InChI=1S/C27H36N4O2/c1-17-29-22-15-19(9-11-23(22)31(17)8)16-28-30-24(32)12-10-18-13-20(26(2,3)4)25(33)21(14-18)27(5,6)7/h9,11,13-16,33H,10,12H2,1-8H3,(H,30,32)

InChI Key

DNWUSCOVSANLNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.127

Distribution Coefficient, logD

5.109

Water Solubility, LogSw

-4.83

Polar Surface Area

62.607

Acid Dissociation Constant (pKa)

9.93

Base Dissociation Constant (pKb)

6.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with K000-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K000-0020?
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What is the minimum amount of K000-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K000-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K000-0020
  • 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 K000-0020 available by request