Y031-7664 Screening compound: (2,6-dimethylmorpholino)(5-nitro-2-furyl)methanone

Y031-7664 Screening compound: (2,6-dimethylmorpholino)(5-nitro-2-furyl)methanone
Y031-7664 Screening compound: (2,6-dimethylmorpholino)(5-nitro-2-furyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7664
(2,6-dimethylmorpholino)(5-nitro-2-furyl)methanone

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

Y031-7664

Molecular Formula

C11H14N2O5 (C11 H14 N2 O5)

Compound Name

(2,6-dimethylmorpholino)(5-nitro-2-furyl)methanone

IUPAC name

26-dimethyl-4-(5-nitrofuran-2-carbonyl)morpholine

SMILES

CC(C1)OC(C)CN1C(c1ccc([N+]([O-])=O)o1)=O

InChI

InChI=1S/C11H14N2O5/c1-7-5-12(6-8(2)17-7)11(14)9-3-4-10(18-9)13(15)16/h3-4,7-8H,5-6H2,1-2H3

InChI Key

HHMVWMCEDGWZPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00451503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

254.24

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.796

Distribution Coefficient, logD

0.796

Water Solubility, LogSw

-1.60

Polar Surface Area

66.480

Acid Dissociation Constant (pKa)

26.37

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

54.54

Y031-7664 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y031-7664 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7664?
Check Price and Availability of Y031-7664, 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 Y031-7664 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7664
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7664
  • 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 Y031-7664 available by request