C260-1933 Screening compound: 4-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-cyclopentylbutanamide

C260-1933 Screening compound: 4-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-cyclopentylbutanamide
C260-1933 Screening compound: 4-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-cyclopentylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1933
4-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-cyclopentylbutanamide

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

C260-1933

Molecular Formula

C24H26ClN3O3 (C24 H26 ClN3 O3)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCCN(C(c(cccc1)c1N1Cc(cc2)ccc2Cl)=O)C1=O)NC1CCCC1

InChI

InChI=1S/C24H26ClN3O3/c25-18-13-11-17(12-14-18)16-28-21-9-4-3-8-20(21)23(30)27(24(28)31)15-5-10-22(29)26-19-6-1-2-7-19/h3-4,8-9,11-14,19H,1-2,5-7,10,15-16H2,(H,26,29)

InChI Key

RMILBQQCYFBPFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.94

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

3.742

Distribution Coefficient, logD

3.742

Water Solubility, LogSw

-4.44

Polar Surface Area

55.808

Acid Dissociation Constant (pKa)

16.14

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C260-1933 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C260-1933 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C260-1933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1933
  • 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 C260-1933 available by request