C260-1073 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

C260-1073 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide
C260-1073 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1073
N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

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

C260-1073

Molecular Formula

C29H30ClN3O3 (C29 H30 ClN3 O3)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-methylphenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}pentanamide

SMILES

Cc1ccc(CN(c(cccc2)c2C(N2CCCCC(NCCc(cc3)ccc3Cl)=O)=O)C2=O)cc1

InChI

InChI=1S/C29H30ClN3O3/c1-21-9-11-23(12-10-21)20-33-26-7-3-2-6-25(26)28(35)32(29(33)36)19-5-4-8-27(34)31-18-17-22-13-15-24(30)16-14-22/h2-3,6-7,9-16H,4-5,8,17-20H2,1H3,(H,31,34)

InChI Key

PZRGLIXOTUVIBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737558

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.03

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.566

Distribution Coefficient, logD

4.566

Water Solubility, LogSw

-4.67

Polar Surface Area

55.558

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

C260-1073 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C260-1073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1073?
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What is the minimum amount of C260-1073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1073
  • 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 C260-1073 available by request