3347-0046 Screening compound: 2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-4,6-dimethylpyrimidine

3347-0046 Screening compound: 2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-4,6-dimethylpyrimidine
3347-0046 Screening compound: 2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-4,6-dimethylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3347-0046
2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-4,6-dimethylpyrimidine

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

3347-0046

Molecular Formula

C13H13FN4 (C13 H13 FN4)

Compound Name

2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-4,6-dimethylpyrimidine

IUPAC name

2-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazin-1-yl]-46-dimethylpyrimidine

SMILES

Cc1nc(N/N=C/c(cc2)ccc2F)nc(C)c1

InChI

InChI=1S/C13H13FN4/c1-9-7-10(2)17-13(16-9)18-15-8-11-3-5-12(14)6-4-11/h3-8H,1-2H3,(H,16,17,18)

InChI Key

JMQSTYOWBYSBTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01234008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

244.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.564

Distribution Coefficient, logD

2.563

Water Solubility, LogSw

-2.54

Polar Surface Area

40.694

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

3347-0046 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3347-0046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3347-0046?
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What is the minimum amount of 3347-0046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3347-0046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3347-0046
  • 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 3347-0046 available by request