8003-9513 Screening compound: N-[4-{(Z)-2-[(E)-1-(4-iodophenyl)methylidene]hydrazono}-6-morpholino-1,3,5-triazin-2(3H)-yl]-N-phenylamine

8003-9513 Screening compound: N-[4-{(Z)-2-[(E)-1-(4-iodophenyl)methylidene]hydrazono}-6-morpholino-1,3,5-triazin-2(3H)-yl]-N-phenylamine
8003-9513 Screening compound: N-[4-{(Z)-2-[(E)-1-(4-iodophenyl)methylidene]hydrazono}-6-morpholino-1,3,5-triazin-2(3H)-yl]-N-phenylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-9513
N-[4-{(Z)-2-[(E)-1-(4-iodophenyl)methylidene]hydrazono}-6-morpholino-1,3,5-triazin-2(3H)-yl]-N-phenylamine

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

8003-9513

Molecular Formula

C20H20IN7O (C20 H20 IN7 O)

Compound Name

N-[4-{(Z)-2-[(E)-1-(4-iodophenyl)methylidene]hydrazono}-6-morpholino-1,3,5-triazin-2(3H)-yl]-N-phenylamine

IUPAC name

n/a

SMILES

Ic1ccc(/C=N/N=C2\N=C(N3CCOCC3)N=C(Nc3ccccc3)N2)cc1

InChI

InChI=1S/C20H20IN7O/c21-16-8-6-15(7-9-16)14-22-27-19-24-18(23-17-4-2-1-3-5-17)25-20(26-19)28-10-12-29-13-11-28/h1-9,14H,10-13H2,(H2,23,24,25,26,27)

InChI Key

OCMHEKUMDIMWLC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.949

Distribution Coefficient, logD

3.859

Water Solubility, LogSw

-3.98

Polar Surface Area

70.632

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

6.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

8003-9513 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8003-9513 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-9513?
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What is the minimum amount of 8003-9513 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-9513
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-9513
  • 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 8003-9513 available by request