C260-1916 Screening compound: 5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide

C260-1916 Screening compound: 5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide
C260-1916 Screening compound: 5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1916
5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide

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

C260-1916

Molecular Formula

C28H38N4O4 (C28 H38 N4 O4)

Compound Name

5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide

IUPAC name

5-[1-({[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}methyl)-24-dioxo-1234-tetrahydroquinazolin-3-yl]-N-cyclopentylpentanamide

SMILES

O=C(CCCCN(C(c(cccc1)c1N1CC(NCCC2=CCCCC2)=O)=O)C1=O)NC1CCCC1

InChI

InChI=1S/C28H38N4O4/c33-25(30-22-12-4-5-13-22)16-8-9-19-31-27(35)23-14-6-7-15-24(23)32(28(31)36)20-26(34)29-18-17-21-10-2-1-3-11-21/h6-7,10,14-15,22H,1-5,8-9,11-13,16-20H2,(H,29,34)(H,30,33)

InChI Key

LHMOEWQLGFINRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.791

Distribution Coefficient, logD

2.791

Water Solubility, LogSw

-3.52

Polar Surface Area

80.313

Acid Dissociation Constant (pKa)

15.38

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

C260-1916 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C260-1916 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1916?
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What is the minimum amount of C260-1916 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1916
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1916
  • 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 C260-1916 available by request