Y020-5710 Screening compound: (1E)-4,4,7-trimethyl-N-[4-(propan-2-yl)phenyl]-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine

Y020-5710 Screening compound: (1E)-4,4,7-trimethyl-N-[4-(propan-2-yl)phenyl]-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine
Y020-5710 Screening compound: (1E)-4,4,7-trimethyl-N-[4-(propan-2-yl)phenyl]-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-5710
(1E)-4,4,7-trimethyl-N-[4-(propan-2-yl)phenyl]-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine

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

Y020-5710

Molecular Formula

C22H24N2S2 (C22 H24 N2 S2)

Compound Name

(1E)-4,4,7-trimethyl-N-[4-(propan-2-yl)phenyl]-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine

IUPAC name

(1E)-447-trimethyl-N-[4-(propan-2-yl)phenyl]-1H4H5H-[12]dithiolo[34-c]quinolin-1-imine

SMILES

CC(C)c(cc1)ccc1/N=C1/SSC2=C1c(ccc(C)c1)c1NC2(C)C

InChI

InChI=1S/C22H24N2S2/c1-13(2)15-7-9-16(10-8-15)23-21-19-17-11-6-14(3)12-18(17)24-22(4,5)20(19)25-26-21/h6-13,24H,1-5H3

InChI Key

ZSCRQHIOVKAYKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03488019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.58

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.013

Distribution Coefficient, logD

6.013

Water Solubility, LogSw

-5.82

Polar Surface Area

19.624

Acid Dissociation Constant (pKa)

19.80

Base Dissociation Constant (pKb)

2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

Y020-5710 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-5710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-5710?
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What is the minimum amount of Y020-5710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-5710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-5710
  • 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 Y020-5710 available by request