C260-3063 Screening compound: 2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide

C260-3063 Screening compound: 2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide
C260-3063 Screening compound: 2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-3063
2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide

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

C260-3063

Molecular Formula

C28H27ClN4O5 (C28 H27 ClN4 O5)

Compound Name

2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide

IUPAC name

2-(1-{[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]methyl}-24-dioxo-1234-tetrahydroquinazolin-3-yl)-N-(2-phenylethyl)acetamide

SMILES

Cc(cc(c(OC)c1)NC(CN(c(cccc2)c2C(N2CC(NCCc3ccccc3)=O)=O)C2=O)=O)c1Cl

InChI

InChI=1S/C28H27ClN4O5/c1-18-14-22(24(38-2)15-21(18)29)31-26(35)17-32-23-11-7-6-10-20(23)27(36)33(28(32)37)16-25(34)30-13-12-19-8-4-3-5-9-19/h3-11,14-15H,12-13,16-17H2,1-2H3,(H,30,34)(H,31,35)

InChI Key

NZFTYDGRQSZZFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

535

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

3.427

Water Solubility, LogSw

-3.90

Polar Surface Area

85.662

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C260-3063 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C260-3063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-3063?
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What is the minimum amount of C260-3063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-3063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-3063
  • 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 C260-3063 available by request