C260-2336 Screening compound: 4-{[1-(carbamoylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

C260-2336 Screening compound: 4-{[1-(carbamoylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
C260-2336 Screening compound: 4-{[1-(carbamoylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2336
4-{[1-(carbamoylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]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

C260-2336

Molecular Formula

C28H28N4O6 (C28 H28 N4 O6)

Compound Name

4-{[1-(carbamoylmethyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

IUPAC name

4-{[1-(carbamoylmethyl)-24-dioxo-1234-tetrahydroquinazolin-3-yl]methyl}-N-[2-(34-dimethoxyphenyl)ethyl]benzamide

SMILES

COc(ccc(CCNC(c1ccc(CN(C(c(cccc2)c2N2CC(N)=O)=O)C2=O)cc1)=O)c1)c1OC

InChI

InChI=1S/C28H28N4O6/c1-37-23-12-9-18(15-24(23)38-2)13-14-30-26(34)20-10-7-19(8-11-20)16-32-27(35)21-5-3-4-6-22(21)31(28(32)36)17-25(29)33/h3-12,15H,13-14,16-17H2,1-2H3,(H2,29,33)(H,30,34)

InChI Key

KVHLSDMOHPLWJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

516.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.312

Distribution Coefficient, logD

1.312

Water Solubility, LogSw

-2.43

Polar Surface Area

104.442

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C260-2336 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with C260-2336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2336?
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What is the minimum amount of C260-2336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2336
  • 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 C260-2336 available by request