8001-6684 Screening compound: 2-{2-[(E)-1-(4-hydroxy-3-methoxyphenyl)methylidene]hydrazino}-N~1~-isobutyl-2-oxoacetamide

8001-6684 Screening compound: 2-{2-[(E)-1-(4-hydroxy-3-methoxyphenyl)methylidene]hydrazino}-N~1~-isobutyl-2-oxoacetamide
8001-6684 Screening compound: 2-{2-[(E)-1-(4-hydroxy-3-methoxyphenyl)methylidene]hydrazino}-N~1~-isobutyl-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-6684
2-{2-[(E)-1-(4-hydroxy-3-methoxyphenyl)methylidene]hydrazino}-N~1~-isobutyl-2-oxoacetamide

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

8001-6684

Molecular Formula

C14H19N3O4 (C14 H19 N3 O4)

Compound Name

2-{2-[(E)-1-(4-hydroxy-3-methoxyphenyl)methylidene]hydrazino}-N~1~-isobutyl-2-oxoacetamide

IUPAC name

n/a

SMILES

CC(C)CNC(C(N/N=C/c(cc1)cc(OC)c1O)=O)=O

InChI

InChI=1S/C14H19N3O4/c1-9(2)7-15-13(19)14(20)17-16-8-10-4-5-11(18)12(6-10)21-3/h4-6,8-9,18H,7H2,1-3H3,(H,15,19)(H,17,20)

InChI Key

MQHJFGGAYRCWBU-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.119

Distribution Coefficient, logD

-0.088

Water Solubility, LogSw

-2.08

Polar Surface Area

84.689

Acid Dissociation Constant (pKa)

6.22

Base Dissociation Constant (pKb)

-3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

8001-6684 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8001-6684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-6684?
Check Price and Availability of 8001-6684, 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 8001-6684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-6684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-6684
  • 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 8001-6684 available by request