8003-2777 Screening compound: N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide

8003-2777 Screening compound: N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide
8003-2777 Screening compound: N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-2777
N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide

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

8003-2777

Molecular Formula

C34H34N4O3 (C34 H34 N4 O3)

Compound Name

N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide

IUPAC name

N-[(1E)-1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-2-[4-(diethylamino)phenyl]eth-1-en-1-yl]benzamide

SMILES

CCN(CC)c1ccc(/C=C(\C(N/N=C/c(cc2)ccc2OCc2ccccc2)=O)/NC(c2ccccc2)=O)cc1

InChI

InChI=1S/C34H34N4O3/c1-3-38(4-2)30-19-15-26(16-20-30)23-32(36-33(39)29-13-9-6-10-14-29)34(40)37-35-24-27-17-21-31(22-18-27)41-25-28-11-7-5-8-12-28/h5-24H,3-4,25H2,1-2H3,(H,36,39)(H,37,40)

InChI Key

RNLDPHTZAJVDRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00734776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.67

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.317

Distribution Coefficient, logD

4.443

Water Solubility, LogSw

-5.63

Polar Surface Area

67.443

Acid Dissociation Constant (pKa)

5.53

Base Dissociation Constant (pKb)

8.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.70

8003-2777 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8003-2777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-2777?
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What is the minimum amount of 8003-2777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-2777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-2777
  • 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 8003-2777 available by request