Y600-1322 Screening compound: 3-(4-benzhydrylpiperazino)-6-chloro-4-phenyl-2(1H)-quinolinone

Y600-1322 Screening compound: 3-(4-benzhydrylpiperazino)-6-chloro-4-phenyl-2(1H)-quinolinone
Y600-1322 Screening compound: 3-(4-benzhydrylpiperazino)-6-chloro-4-phenyl-2(1H)-quinolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-1322
3-(4-benzhydrylpiperazino)-6-chloro-4-phenyl-2(1H)-quinolinone

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

Y600-1322

Molecular Formula

C32H28ClN3O (C32 H28 ClN3 O)

Compound Name

3-(4-benzhydrylpiperazino)-6-chloro-4-phenyl-2(1H)-quinolinone

IUPAC name

6-chloro-3-[4-(diphenylmethyl)piperazin-1-yl]-4-phenyl-12-dihydroquinolin-2-one

SMILES

O=C1Nc(ccc(Cl)c2)c2C(c2ccccc2)=C1N(CC1)CCN1C(c1ccccc1)c1ccccc1

InChI

InChI=1S/C32H28ClN3O/c33-26-16-17-28-27(22-26)29(23-10-4-1-5-11-23)31(32(37)34-28)36-20-18-35(19-21-36)30(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-17,22,30H,18-21H2,(H,34,37)

InChI Key

YZNIFSRDTPSDTD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.05

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.334

Distribution Coefficient, logD

7.244

Water Solubility, LogSw

-6.53

Polar Surface Area

30.776

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.63

Y600-1322 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y600-1322 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-1322?
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What is the minimum amount of Y600-1322 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-1322
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-1322
  • 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 Y600-1322 available by request