4286-0158 Screening compound: (3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-2,4-dione

4286-0158 Screening compound: (3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-2,4-dione
4286-0158 Screening compound: (3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4286-0158
(3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-2,4-dione

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

4286-0158

Molecular Formula

C13H14N2O2 (C13 H14 N2 O2)

Compound Name

(3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-2,4-dione

IUPAC name

(3Z)-3-{[(1-phenylethyl)amino]methylidene}pyrrolidine-24-dione

SMILES

CC(c1ccccc1)N/C=C(/C(CN1)=O)\C1=O

InChI

InChI=1S/C13H14N2O2/c1-9(10-5-3-2-4-6-10)14-7-11-12(16)8-15-13(11)17/h2-7,9,14H,8H2,1H3,(H,15,17)/t9-/m0/s1

InChI Key

JVVNYTFDUJVADS-VIFPVBQESA-N

MDL Number (MFCD)

MFCD03016588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

230.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.845

Distribution Coefficient, logD

0.844

Water Solubility, LogSw

-1.78

Polar Surface Area

50.871

Acid Dissociation Constant (pKa)

10.28

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with 4286-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4286-0158?
Check Price and Availability of 4286-0158, 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 4286-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4286-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4286-0158
  • 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 4286-0158 available by request