C260-1826 Screening compound: 4-({1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide

C260-1826 Screening compound: 4-({1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide
C260-1826 Screening compound: 4-({1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1826
4-({1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide

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

C260-1826

Molecular Formula

C28H26ClN3O3 (C28 H26 ClN3 O3)

Compound Name

4-({1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide

IUPAC name

4-({1-[(4-chlorophenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}methyl)-N-cyclopentylbenzamide

SMILES

O=C(c1ccc(CN(C(c(cccc2)c2N2Cc(cc3)ccc3Cl)=O)C2=O)cc1)NC1CCCC1

InChI

InChI=1S/C28H26ClN3O3/c29-22-15-11-20(12-16-22)17-31-25-8-4-3-7-24(25)27(34)32(28(31)35)18-19-9-13-21(14-10-19)26(33)30-23-5-1-2-6-23/h3-4,7-16,23H,1-2,5-6,17-18H2,(H,30,33)

InChI Key

WAAJXQZYJHVXMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.283

Distribution Coefficient, logD

5.283

Water Solubility, LogSw

-5.88

Polar Surface Area

55.771

Acid Dissociation Constant (pKa)

14.73

Base Dissociation Constant (pKb)

-1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C260-1826 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

GABA Library (7115 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C260-1826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1826?
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What is the minimum amount of C260-1826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1826
  • 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 C260-1826 available by request