K297-0543 Screening compound: N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine

K297-0543 Screening compound: N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine
K297-0543 Screening compound: N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound K297-0543
N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine

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

K297-0543

Molecular Formula

C21H15FN4O2S (C21 H15 FN4 O2 S)

Compound Name

N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine

IUPAC name

N-(4-fluorophenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine

SMILES

[O-][N+](c1cccc(CSc2nc3ccccc3c(Nc(cc3)ccc3F)n2)c1)=O

InChI

InChI=1S/C21H15FN4O2S/c22-15-8-10-16(11-9-15)23-20-18-6-1-2-7-19(18)24-21(25-20)29-13-14-4-3-5-17(12-14)26(27)28/h1-12H,13H2,(H,23,24,25)

InChI Key

XEHIONDMYBULNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.922

Distribution Coefficient, logD

5.922

Water Solubility, LogSw

-6.39

Polar Surface Area

59.909

Acid Dissociation Constant (pKa)

16.36

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with K297-0543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K297-0543?
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What is the minimum amount of K297-0543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K297-0543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K297-0543
  • 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 K297-0543 available by request