8019-8328 Screening compound: 2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-2,3-dihydrofuran-3-ylidene]propanedinitrile

8019-8328 Screening compound: 2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-2,3-dihydrofuran-3-ylidene]propanedinitrile
8019-8328 Screening compound: 2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-2,3-dihydrofuran-3-ylidene]propanedinitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8328
2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-2,3-dihydrofuran-3-ylidene]propanedinitrile

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

8019-8328

Molecular Formula

C13H14N4O2 (C13 H14 N4 O2)

Compound Name

2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-2,3-dihydrofuran-3-ylidene]propanedinitrile

IUPAC name

2-[5-amino-2-(butan-2-yloxy)-4-cyano-2-methyl-23-dihydrofuran-3-ylidene]propanedinitrile

SMILES

CCC(C)OC(C)(C1=C(C#N)C#N)OC(N)=C1C#N

InChI

InChI=1S/C13H14N4O2/c1-4-8(2)18-13(3)11(9(5-14)6-15)10(7-16)12(17)19-13/h8H,4,17H2,1-3H3

InChI Key

YIVNWQUPGIMYBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12033773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.594

Distribution Coefficient, logD

1.594

Water Solubility, LogSw

-1.26

Polar Surface Area

88.078

Acid Dissociation Constant (pKa)

12.17

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.20

References: we are preparing a list of scientific research reports with 8019-8328 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8328?
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What is the minimum amount of 8019-8328 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8328
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8328
  • 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 8019-8328 available by request