Y020-0546 Screening compound: 4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide

Y020-0546 Screening compound: 4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide
Y020-0546 Screening compound: 4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-0546
4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide

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

Y020-0546

Molecular Formula

C23H17Cl2N3OS (C23 H17 Cl2 N3 OS)

Compound Name

4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide

IUPAC name

4-chloro-N-{2-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]ethyl}benzamide

SMILES

O=C(c(cc1)ccc1Cl)NCCSc1nc(-c2ccccc2)c(cc(cc2)Cl)c2n1

InChI

InChI=1S/C23H17Cl2N3OS/c24-17-8-6-16(7-9-17)22(29)26-12-13-30-23-27-20-11-10-18(25)14-19(20)21(28-23)15-4-2-1-3-5-15/h1-11,14H,12-13H2,(H,26,29)

InChI Key

WWKYFABYRMROOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03941348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.966

Distribution Coefficient, logD

5.966

Water Solubility, LogSw

-6.27

Polar Surface Area

42.000

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

Y020-0546 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with Y020-0546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-0546?
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What is the minimum amount of Y020-0546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-0546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-0546
  • 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 Y020-0546 available by request