C260-1576 Screening compound: 4-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]butanamide

C260-1576 Screening compound: 4-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]butanamide
C260-1576 Screening compound: 4-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1576
4-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]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

C260-1576

Molecular Formula

C32H35N5O5 (C32 H35 N5 O5)

Compound Name

4-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]butanamide

IUPAC name

4-{24-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1234-tetrahydroquinazolin-3-yl}-N-[(2-methoxyphenyl)methyl]butanamide

SMILES

COc1c(CNC(CCCN(C(c(cccc2)c2N2CC(N(CC3)CCN3c3ccccc3)=O)=O)C2=O)=O)cccc1

InChI

InChI=1S/C32H35N5O5/c1-42-28-15-8-5-10-24(28)22-33-29(38)16-9-17-36-31(40)26-13-6-7-14-27(26)37(32(36)41)23-30(39)35-20-18-34(19-21-35)25-11-3-2-4-12-25/h2-8,10-15H,9,16-23H2,1H3,(H,33,38)

InChI Key

UAXSJPJLOYFMBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738005

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

569.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.449

Distribution Coefficient, logD

2.449

Water Solubility, LogSw

-2.99

Polar Surface Area

83.000

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

C260-1576 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C260-1576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1576?
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What is the minimum amount of C260-1576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1576
  • 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 C260-1576 available by request