1679-0886 Screening compound: (2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide

1679-0886 Screening compound: (2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide
1679-0886 Screening compound: (2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1679-0886
(2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide

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

1679-0886

Molecular Formula

C19H18N4O5 (C19 H18 N4 O5)

Compound Name

(2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide

IUPAC name

(2E)-3-(2-methoxyphenyl)-N-({N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)prop-2-enamide

SMILES

COc1c(/C=C/C(NCC(N/N=C/c(cccc2)c2[N+]([O-])=O)=O)=O)cccc1

InChI

InChI=1S/C19H18N4O5/c1-28-17-9-5-3-6-14(17)10-11-18(24)20-13-19(25)22-21-12-15-7-2-4-8-16(15)23(26)27/h2-12H,13H2,1H3,(H,20,24)(H,22,25)

InChI Key

YSQBECIITZPTLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01131937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.329

Distribution Coefficient, logD

3.327

Water Solubility, LogSw

-3.76

Polar Surface Area

100.523

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

1679-0886 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 1679-0886 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1679-0886?
Check Price and Availability of 1679-0886, 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 1679-0886 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1679-0886
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1679-0886
  • 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 1679-0886 available by request