C260-2226 Screening compound: N-[(2-chlorophenyl)methyl]-4-[2,4-dioxo-1-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-1,2,3,4-tetrahydroquinazolin-3-yl]butanamide

C260-2226 Screening compound: N-[(2-chlorophenyl)methyl]-4-[2,4-dioxo-1-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-1,2,3,4-tetrahydroquinazolin-3-yl]butanamide
C260-2226 Screening compound: N-[(2-chlorophenyl)methyl]-4-[2,4-dioxo-1-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-1,2,3,4-tetrahydroquinazolin-3-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2226
N-[(2-chlorophenyl)methyl]-4-[2,4-dioxo-1-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-1,2,3,4-tetrahydroquinazolin-3-yl]butanamide

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

C260-2226

Molecular Formula

C28H24ClN5O4 (C28 H24 ClN5 O4)

Compound Name

N-[(2-chlorophenyl)methyl]-4-[2,4-dioxo-1-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-1,2,3,4-tetrahydroquinazolin-3-yl]butanamide

IUPAC name

N-[(2-chlorophenyl)methyl]-4-[24-dioxo-1-({4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)-1234-tetrahydroquinazolin-3-yl]butanamide

SMILES

O=C(CCCN(C(c(cccc1)c1N1CC(N=C2N3C=CC=C2)=CC3=O)=O)C1=O)NCc(cccc1)c1Cl

InChI

InChI=1S/C28H24ClN5O4/c29-22-10-3-1-8-19(22)17-30-25(35)13-7-15-33-27(37)21-9-2-4-11-23(21)34(28(33)38)18-20-16-26(36)32-14-6-5-12-24(32)31-20/h1-6,8-12,14,16H,7,13,15,17-18H2,(H,30,35)

InChI Key

ABPDYULMPXSMEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738474

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

529.98

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.309

Distribution Coefficient, logD

2.309

Water Solubility, LogSw

-3.54

Polar Surface Area

81.703

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

C260-2226 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C260-2226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2226?
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What is the minimum amount of C260-2226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2226
  • 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 C260-2226 available by request