1487-1664 Screening compound: prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate

1487-1664 Screening compound: prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate
1487-1664 Screening compound: prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1487-1664
prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate

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

1487-1664

Molecular Formula

C18H15NO3 (C18 H15 NO3)

Compound Name

prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate

IUPAC name

prop-2-en-1-yl (2E)-2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoate

SMILES

Cc(cc1)ccc1-c1ccc(/C=C(/C(OCC=C)=O)\C#N)o1

InChI

InChI=1S/C18H15NO3/c1-3-10-21-18(20)15(12-19)11-16-8-9-17(22-16)14-6-4-13(2)5-7-14/h3-9,11H,1,10H2,2H3

InChI Key

GHOPAFKYTWJCQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01838885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.376

Distribution Coefficient, logD

4.376

Water Solubility, LogSw

-4.41

Polar Surface Area

45.912

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1487-1664 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 1487-1664 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1487-1664?
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What is the minimum amount of 1487-1664 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1487-1664
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1487-1664
  • 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 1487-1664 available by request