F453-0120 Screening compound: 9-(2,6-dichlorophenyl)-6,6-dimethyl-N-(4-methylphenyl)-8-oxo-4H,5H,6H,7H,8H,9H-pyrazolo[3,2-b]quinazoline-3-carboxamide

F453-0120 Screening compound: 9-(2,6-dichlorophenyl)-6,6-dimethyl-N-(4-methylphenyl)-8-oxo-4H,5H,6H,7H,8H,9H-pyrazolo[3,2-b]quinazoline-3-carboxamide
F453-0120 Screening compound: 9-(2,6-dichlorophenyl)-6,6-dimethyl-N-(4-methylphenyl)-8-oxo-4H,5H,6H,7H,8H,9H-pyrazolo[3,2-b]quinazoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F453-0120
9-(2,6-dichlorophenyl)-6,6-dimethyl-N-(4-methylphenyl)-8-oxo-4H,5H,6H,7H,8H,9H-pyrazolo[3,2-b]quinazoline-3-carboxamide

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

F453-0120

Molecular Formula

C26H24Cl2N4O2 (C26 H24 Cl2 N4 O2)

Compound Name

9-(2,6-dichlorophenyl)-6,6-dimethyl-N-(4-methylphenyl)-8-oxo-4H,5H,6H,7H,8H,9H-pyrazolo[3,2-b]quinazoline-3-carboxamide

IUPAC name

9-(26-dichlorophenyl)-66-dimethyl-N-(4-methylphenyl)-8-oxo-4H5H6H7H8H9H-pyrazolo[32-b]quinazoline-3-carboxamide

SMILES

CC(C)(C1)CC(Nc(n(C2c(c(Cl)ccc3)c3Cl)nc3)c3C(Nc3ccc(C)cc3)=O)=C2C1=O

InChI

InChI=1S/C26H24Cl2N4O2/c1-14-7-9-15(10-8-14)30-25(34)16-13-29-32-23(21-17(27)5-4-6-18(21)28)22-19(31-24(16)32)11-26(2,3)12-20(22)33/h4-10,13,23,31H,11-12H2,1-3H3,(H,30,34)/t23-/m0/s1

InChI Key

PAYBBEXIZQVPBX-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD27130163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.308

Distribution Coefficient, logD

5.173

Water Solubility, LogSw

-5.75

Polar Surface Area

60.822

Acid Dissociation Constant (pKa)

7.84

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with F453-0120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F453-0120?
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What is the minimum amount of F453-0120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F453-0120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F453-0120
  • 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 F453-0120 available by request