C260-2023 Screening compound: 7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

C260-2023 Screening compound: 7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
C260-2023 Screening compound: 7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2023
7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

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

C260-2023

Molecular Formula

C22H23ClN4O3 (C22 H23 ClN4 O3)

Compound Name

7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

7-chloro-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1234-tetrahydroquinazoline-24-dione

SMILES

O=C(CCCN(C(c(ccc(Cl)c1)c1N1)=O)C1=O)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C22H23ClN4O3/c23-16-8-9-18-19(15-16)24-22(30)27(21(18)29)10-4-7-20(28)26-13-11-25(12-14-26)17-5-2-1-3-6-17/h1-3,5-6,8-9,15H,4,7,10-14H2,(H,24,30)

InChI Key

CJGNKVWCYUGMEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.818

Distribution Coefficient, logD

2.760

Water Solubility, LogSw

-3.74

Polar Surface Area

60.111

Acid Dissociation Constant (pKa)

8.24

Base Dissociation Constant (pKb)

6.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.82

C260-2023 in Drug Discovery

Included in Screening Libraries

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

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C260-2023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2023?
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What is the minimum amount of C260-2023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2023
  • 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 C260-2023 available by request