3257-3050 Screening compound: 4-(morpholin-4-yl)-5-nitrobenzene-1,2-dicarbonitrile

3257-3050 Screening compound: 4-(morpholin-4-yl)-5-nitrobenzene-1,2-dicarbonitrile
3257-3050 Screening compound: 4-(morpholin-4-yl)-5-nitrobenzene-1,2-dicarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-3050
4-(morpholin-4-yl)-5-nitrobenzene-1,2-dicarbonitrile

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

3257-3050

Molecular Formula

C12H10N4O3 (C12 H10 N4 O3)

Compound Name

4-(morpholin-4-yl)-5-nitrobenzene-1,2-dicarbonitrile

IUPAC name

4-(morpholin-4-yl)-5-nitrobenzene-12-dicarbonitrile

SMILES

N#Cc(c(C#N)c1)cc(N2CCOCC2)c1[N+]([O-])=O

InChI

InChI=1S/C12H10N4O3/c13-7-9-5-11(15-1-3-19-4-2-15)12(16(17)18)6-10(9)8-14/h5-6H,1-4H2

InChI Key

SQJCBBDYGBLGAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.303

Distribution Coefficient, logD

1.303

Water Solubility, LogSw

-2.08

Polar Surface Area

78.492

Acid Dissociation Constant (pKa)

28.26

Base Dissociation Constant (pKb)

-5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 3257-3050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-3050?
Check Price and Availability of 3257-3050, 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 3257-3050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-3050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-3050
  • 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 3257-3050 available by request