3606-0524 Screening compound: 2,2-dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione

3606-0524 Screening compound: 2,2-dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione
3606-0524 Screening compound: 2,2-dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3606-0524
2,2-dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-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

3606-0524

Molecular Formula

C10H13NO4 (C10 H13 NO4)

Compound Name

2,2-dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione

IUPAC name

22-dimethyl-5-(pyrrolidin-2-ylidene)-13-dioxane-46-dione

SMILES

CC(C)(OC(C1=C2NCCC2)=O)OC1=O

InChI

InChI=1S/C10H13NO4/c1-10(2)14-8(12)7(9(13)15-10)6-4-3-5-11-6/h11H,3-5H2,1-2H3

InChI Key

HPMYPUSZJRSKIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00067006

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

211.22

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.464

Distribution Coefficient, logD

-0.164

Water Solubility, LogSw

-0.12

Polar Surface Area

53.647

Acid Dissociation Constant (pKa)

6.89

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

3606-0524 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 3606-0524 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3606-0524?
Check Price and Availability of 3606-0524, 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 3606-0524 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3606-0524
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3606-0524
  • 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 3606-0524 available by request