K089-0073 Screening compound: 2-(4-chloro-2-methylphenoxy)-N'~1~-((E)-1-{4-ethoxy-3-[(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)methyl]phenyl}methylidene)acetohydrazide

K089-0073 Screening compound: 2-(4-chloro-2-methylphenoxy)-N'~1~-((E)-1-{4-ethoxy-3-[(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)methyl]phenyl}methylidene)acetohydrazide
K089-0073 Screening compound: 2-(4-chloro-2-methylphenoxy)-N'~1~-((E)-1-{4-ethoxy-3-[(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)methyl]phenyl}methylidene)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K089-0073
2-(4-chloro-2-methylphenoxy)-N'~1~-((E)-1-{4-ethoxy-3-[(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)methyl]phenyl}methylidene)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

K089-0073

Molecular Formula

C30H33ClN4O4 (C30 H33 ClN4 O4)

Compound Name

2-(4-chloro-2-methylphenoxy)-N'~1~-((E)-1-{4-ethoxy-3-[(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)methyl]phenyl}methylidene)acetohydrazide

IUPAC name

2-(4-chloro-2-methylphenoxy)-N'-[(E)-[4-ethoxy-3-({6-oxo-711-diazatricyclo[7.3.1.0^{27}]trideca-24-dien-11-yl}methyl)phenyl]methylidene]acetohydrazide

SMILES

CCOc1c(CN(CC(C2)CN34)CC2C4=CC=CC3=O)cc(/C=N/NC(COc(cc2)c(C)cc2Cl)=O)cc1

InChI

InChI=1S/C30H33ClN4O4/c1-3-38-28-9-7-21(14-32-33-29(36)19-39-27-10-8-25(31)11-20(27)2)12-24(28)18-34-15-22-13-23(17-34)26-5-4-6-30(37)35(26)16-22/h4-12,14,22-23H,3,13,15-19H2,1-2H3,(H,33,36)

InChI Key

QFZVVSZHNYGLOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01843859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

549.07

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.610

Distribution Coefficient, logD

5.199

Water Solubility, LogSw

-6.04

Polar Surface Area

69.568

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

7.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.70

References: we are preparing a list of scientific research reports with K089-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K089-0073?
Check Price and Availability of K089-0073, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K089-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K089-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K089-0073
  • 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 K089-0073 available by request