K089-0136 Screening compound: 3-tert-butyl-N'-[(E)-{3-[(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}methylidene]-1H-pyrazole-5-carbohydrazide

K089-0136 Screening compound: 3-tert-butyl-N'-[(E)-{3-[(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}methylidene]-1H-pyrazole-5-carbohydrazide
K089-0136 Screening compound: 3-tert-butyl-N'-[(E)-{3-[(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}methylidene]-1H-pyrazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K089-0136
3-tert-butyl-N'-[(E)-{3-[(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}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

K089-0136

Molecular Formula

C29H37N5O4 (C29 H37 N5 O4)

Compound Name

3-tert-butyl-N'-[(E)-{3-[(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}methylidene]-1H-pyrazole-5-carbohydrazide

IUPAC name

3-tert-butyl-N'-[(E)-{3-[(67-dimethoxy-1-methyl-1234-tetrahydroisoquinolin-2-yl)methyl]-4-methoxyphenyl}methylidene]-1H-pyrazole-5-carbohydrazide

SMILES

CC1N(Cc(cc(/C=N/NC(c2cc(C(C)(C)C)n[nH]2)=O)cc2)c2OC)CCc(cc2OC)c1cc2OC

InChI

InChI=1S/C29H37N5O4/c1-18-22-14-26(38-7)25(37-6)13-20(22)10-11-34(18)17-21-12-19(8-9-24(21)36-5)16-30-33-28(35)23-15-27(32-31-23)29(2,3)4/h8-9,12-16,18H,10-11,17H2,1-7H3,(H,31,32)(H,33,35)/t18-/m0/s1

InChI Key

HIOQQZIZKIDCBD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD01535512

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.390

Distribution Coefficient, logD

3.600

Water Solubility, LogSw

-4.30

Polar Surface Area

83.942

Acid Dissociation Constant (pKa)

10.48

Base Dissociation Constant (pKb)

8.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.40

References: we are preparing a list of scientific research reports with K089-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K089-0136?
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What is the minimum amount of K089-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K089-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K089-0136
  • 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 K089-0136 available by request