Y600-1403 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinyl)sulfanyl]-3-(3,5-dimethylphenyl)-4(3H)-quinazolinone

Y600-1403 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinyl)sulfanyl]-3-(3,5-dimethylphenyl)-4(3H)-quinazolinone
Y600-1403 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinyl)sulfanyl]-3-(3,5-dimethylphenyl)-4(3H)-quinazolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-1403
2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinyl)sulfanyl]-3-(3,5-dimethylphenyl)-4(3H)-quinazolinone

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

Y600-1403

Molecular Formula

C31H22ClN3O2S (C31 H22 ClN3 O2 S)

Compound Name

2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinyl)sulfanyl]-3-(3,5-dimethylphenyl)-4(3H)-quinazolinone

IUPAC name

2-[(6-chloro-2-oxo-4-phenyl-12-dihydroquinolin-3-yl)sulfanyl]-3-(35-dimethylphenyl)-34-dihydroquinazolin-4-one

SMILES

Cc1cc(N2C(SC3=C(c4ccccc4)c(cc(cc4)Cl)c4NC3=O)=Nc(cccc3)c3C2=O)cc(C)c1

InChI

InChI=1S/C31H22ClN3O2S/c1-18-14-19(2)16-22(15-18)35-30(37)23-10-6-7-11-25(23)34-31(35)38-28-27(20-8-4-3-5-9-20)24-17-21(32)12-13-26(24)33-29(28)36/h3-17H,1-2H3,(H,33,36)

InChI Key

DROGCPIPDSMKRR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.05

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.022

Distribution Coefficient, logD

7.021

Water Solubility, LogSw

-6.24

Polar Surface Area

49.766

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.45

Y600-1403 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y600-1403 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-1403?
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What is the minimum amount of Y600-1403 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-1403
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-1403
  • 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 Y600-1403 available by request