8018-2784 Screening compound: 6-methyl-1-{(E)-1-[3-(2-thienyl)-1H-pyrazol-4-yl]methylidene}furo[3,4-c]pyridine-3,4(1H,5H)-dione

8018-2784 Screening compound: 6-methyl-1-{(E)-1-[3-(2-thienyl)-1H-pyrazol-4-yl]methylidene}furo[3,4-c]pyridine-3,4(1H,5H)-dione
8018-2784 Screening compound: 6-methyl-1-{(E)-1-[3-(2-thienyl)-1H-pyrazol-4-yl]methylidene}furo[3,4-c]pyridine-3,4(1H,5H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2784
6-methyl-1-{(E)-1-[3-(2-thienyl)-1H-pyrazol-4-yl]methylidene}furo[3,4-c]pyridine-3,4(1H,5H)-dione

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

8018-2784

Molecular Formula

C16H11N3O3S (C16 H11 N3 O3 S)

Compound Name

6-methyl-1-{(E)-1-[3-(2-thienyl)-1H-pyrazol-4-yl]methylidene}furo[3,4-c]pyridine-3,4(1H,5H)-dione

IUPAC name

(1E)-6-methyl-1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-1H3H4H5H-furo[34-c]pyridine-34-dione

SMILES

CC(N1)=CC(/C(/OC2=O)=C\c3c[nH]nc3-c3cccs3)=C2C1=O

InChI

InChI=1S/C16H11N3O3S/c1-8-5-10-11(22-16(21)13(10)15(20)18-8)6-9-7-17-19-14(9)12-3-2-4-23-12/h2-7H,1H3,(H,17,19)(H,18,20)

InChI Key

MFFPKDGENOMPBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07657786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.872

Distribution Coefficient, logD

0.095

Water Solubility, LogSw

-2.42

Polar Surface Area

71.995

Acid Dissociation Constant (pKa)

5.63

Base Dissociation Constant (pKb)

-2.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.25

References: we are preparing a list of scientific research reports with 8018-2784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2784?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2784
  • 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 8018-2784 available by request