3279-5284 Screening compound: N-[2-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide

3279-5284 Screening compound: N-[2-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide
3279-5284 Screening compound: N-[2-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3279-5284
N-[2-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide

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

3279-5284

Molecular Formula

C22H15FN4O5 (C22 H15 FN4 O5)

Compound Name

N-[2-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide

IUPAC name

N-[2-(4-fluorophenyl)-4-oxo-34-dihydroquinazolin-3-yl]-4-methoxy-3-nitrobenzamide

SMILES

COc(ccc(C(NN(C(c(cc1)ccc1F)=Nc1c2cccc1)C2=O)=O)c1)c1[N+]([O-])=O

InChI

InChI=1S/C22H15FN4O5/c1-32-19-11-8-14(12-18(19)27(30)31)21(28)25-26-20(13-6-9-15(23)10-7-13)24-17-5-3-2-4-16(17)22(26)29/h2-12H,1H3,(H,25,28)

InChI Key

UVFMIYOVMBJWEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02087198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.130

Distribution Coefficient, logD

2.103

Water Solubility, LogSw

-2.97

Polar Surface Area

92.462

Acid Dissociation Constant (pKa)

8.61

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

References: we are preparing a list of scientific research reports with 3279-5284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3279-5284?
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What is the minimum amount of 3279-5284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3279-5284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3279-5284
  • 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 3279-5284 available by request