8006-1416 Screening compound: N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]prop-2-enamide

8006-1416 Screening compound: N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]prop-2-enamide
8006-1416 Screening compound: N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-1416
N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]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

8006-1416

Molecular Formula

C12H22N2O2 (C12 H22 N2 O2)

Compound Name

N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]prop-2-enamide

IUPAC name

N-[2-methyl-4-(morpholin-4-yl)butan-2-yl]prop-2-enamide

SMILES

CC(C)(CCN1CCOCC1)NC(C=C)=O

InChI

InChI=1S/C12H22N2O2/c1-4-11(15)13-12(2,3)5-6-14-7-9-16-10-8-14/h4H,1,5-10H2,2-3H3,(H,13,15)

InChI Key

NLEJLZJZNHNRCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00454772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

226.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.634

Distribution Coefficient, logD

0.299

Water Solubility, LogSw

-1.47

Polar Surface Area

35.892

Acid Dissociation Constant (pKa)

14.61

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

75.00

8006-1416 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8006-1416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-1416?
Check Price and Availability of 8006-1416, 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 8006-1416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-1416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-1416
  • 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 8006-1416 available by request