Y031-7759 Screening compound: ethyl 1-[(5-nitro-2-furyl)carbonyl]-4-piperidinecarboxylate

Y031-7759 Screening compound: ethyl 1-[(5-nitro-2-furyl)carbonyl]-4-piperidinecarboxylate
Y031-7759 Screening compound: ethyl 1-[(5-nitro-2-furyl)carbonyl]-4-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7759
ethyl 1-[(5-nitro-2-furyl)carbonyl]-4-piperidinecarboxylate

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

Y031-7759

Molecular Formula

C13H16N2O6 (C13 H16 N2 O6)

Compound Name

ethyl 1-[(5-nitro-2-furyl)carbonyl]-4-piperidinecarboxylate

IUPAC name

ethyl 1-(5-nitrofuran-2-carbonyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1ccc([N+]([O-])=O)o1)=O)=O

InChI

InChI=1S/C13H16N2O6/c1-2-20-13(17)9-5-7-14(8-6-9)12(16)10-3-4-11(21-10)15(18)19/h3-4,9H,2,5-8H2,1H3

InChI Key

CFYBVBIJEKTNSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00577532

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.363

Distribution Coefficient, logD

1.363

Water Solubility, LogSw

-1.95

Polar Surface Area

80.301

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.85

References: we are preparing a list of scientific research reports with Y031-7759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7759?
Check Price and Availability of Y031-7759, 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 Y031-7759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7759
  • 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 Y031-7759 available by request