C260-2761 Screening compound: 4-({1-[(4-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide

C260-2761 Screening compound: 4-({1-[(4-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide
C260-2761 Screening compound: 4-({1-[(4-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2761
4-({1-[(4-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide

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

C260-2761

Molecular Formula

C31H26FN3O3 (C31 H26 FN3 O3)

Compound Name

4-({1-[(4-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide

IUPAC name

4-({1-[(4-fluorophenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide

SMILES

Cc1ccc(CNC(c2ccc(CN(C(c(cccc3)c3N3Cc(cc4)ccc4F)=O)C3=O)cc2)=O)cc1

InChI

InChI=1S/C31H26FN3O3/c1-21-6-8-22(9-7-21)18-33-29(36)25-14-10-23(11-15-25)20-35-30(37)27-4-2-3-5-28(27)34(31(35)38)19-24-12-16-26(32)17-13-24/h2-17H,18-20H2,1H3,(H,33,36)

InChI Key

AVNBZCRCXSJELU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.263

Distribution Coefficient, logD

5.263

Water Solubility, LogSw

-5.05

Polar Surface Area

55.680

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

-3.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.90

C260-2761 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C260-2761 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2761?
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What is the minimum amount of C260-2761 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2761
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2761
  • 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 C260-2761 available by request