K206-0112 Screening compound: N'~1~-{(E)-1-[17-(2-chlorophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaen-1-yl]methylidene}-2-nitrobenzohydrazide

K206-0112 Screening compound: N'~1~-{(E)-1-[17-(2-chlorophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaen-1-yl]methylidene}-2-nitrobenzohydrazide
K206-0112 Screening compound: N'~1~-{(E)-1-[17-(2-chlorophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaen-1-yl]methylidene}-2-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K206-0112
N'~1~-{(E)-1-[17-(2-chlorophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaen-1-yl]methylidene}-2-nitrobenzohydrazide

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

K206-0112

Molecular Formula

C32H21ClN4O5 (C32 H21 ClN4 O5)

Compound Name

N'~1~-{(E)-1-[17-(2-chlorophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaen-1-yl]methylidene}-2-nitrobenzohydrazide

IUPAC name

N'-[(E)-[17-(2-chlorophenyl)-1618-dioxo-17-azapentacyclo[6.6.5.0^{27}.0^{914}.0^{1519}]nonadeca-2(7)359(14)1012-hexaen-1-yl]methylidene]-2-nitrobenzohydrazide

SMILES

[O-][N+](c(cccc1)c1C(N/N=C/C(C(C(C12)C(N3c(cccc4)c4Cl)=O)C3=O)(c3c2cccc3)c2c1cccc2)=O)=O

InChI

InChI=1S/C32H21ClN4O5/c33-23-14-6-8-16-25(23)36-30(39)27-26-18-9-1-4-12-21(18)32(28(27)31(36)40,22-13-5-2-10-19(22)26)17-34-35-29(38)20-11-3-7-15-24(20)37(41)42/h1-17,26-28H,(H,35,38)

InChI Key

KRYFZGLHYKFDDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01933533

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

577

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.848

Distribution Coefficient, logD

4.773

Water Solubility, LogSw

-5.00

Polar Surface Area

96.545

Acid Dissociation Constant (pKa)

8.12

Base Dissociation Constant (pKb)

-3.48

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with K206-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K206-0112?
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What is the minimum amount of K206-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K206-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K206-0112
  • 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 K206-0112 available by request