Y021-2704 Screening compound: 8-methoxy-4,4,6-trimethyl-1-[(E)-1-(4-methylphenyl)methylidene]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

Y021-2704 Screening compound: 8-methoxy-4,4,6-trimethyl-1-[(E)-1-(4-methylphenyl)methylidene]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Y021-2704 Screening compound: 8-methoxy-4,4,6-trimethyl-1-[(E)-1-(4-methylphenyl)methylidene]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-2704
8-methoxy-4,4,6-trimethyl-1-[(E)-1-(4-methylphenyl)methylidene]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

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

Y021-2704

Molecular Formula

C23H23NO2 (C23 H23 NO2)

Compound Name

8-methoxy-4,4,6-trimethyl-1-[(E)-1-(4-methylphenyl)methylidene]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

IUPAC name

(3E)-6-methoxy-91111-trimethyl-3-[(4-methylphenyl)methylidene]-1-azatricyclo[6.3.1.0^{412}]dodeca-4(12)579-tetraen-2-one

SMILES

CC(C)(C=C(C)c1cc(OC)cc(/C2=C\c3ccc(C)cc3)c11)N1C2=O

InChI

InChI=1S/C23H23NO2/c1-14-6-8-16(9-7-14)10-20-19-12-17(26-5)11-18-15(2)13-23(3,4)24(21(18)19)22(20)25/h6-13H,1-5H3

InChI Key

ZBSUGNPXRIAAKZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32220848

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.382

Distribution Coefficient, logD

5.382

Water Solubility, LogSw

-5.55

Polar Surface Area

23.965

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.09

References: we are preparing a list of scientific research reports with Y021-2704 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-2704?
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What is the minimum amount of Y021-2704 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-2704
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-2704
  • 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 Y021-2704 available by request