Y021-2757 Screening compound: 8-methoxy-4,4,6-trimethyl-1-(2-oxo-2-phenylethyl)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

Y021-2757 Screening compound: 8-methoxy-4,4,6-trimethyl-1-(2-oxo-2-phenylethyl)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Y021-2757 Screening compound: 8-methoxy-4,4,6-trimethyl-1-(2-oxo-2-phenylethyl)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-2757
8-methoxy-4,4,6-trimethyl-1-(2-oxo-2-phenylethyl)-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

Y021-2757

Molecular Formula

C23H23NO3 (C23 H23 NO3)

Compound Name

8-methoxy-4,4,6-trimethyl-1-(2-oxo-2-phenylethyl)-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

IUPAC name

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

SMILES

CC(C)(C=C(C)c1c2)N(C(C3CC(c4ccccc4)=O)=O)c1c3cc2OC

InChI

InChI=1S/C23H23NO3/c1-14-13-23(2,3)24-21-17(14)10-16(27-4)11-18(21)19(22(24)26)12-20(25)15-8-6-5-7-9-15/h5-11,13,19H,12H2,1-4H3/t19-/m0/s1

InChI Key

DFFYCOUTFMELDN-IBGZPJMESA-N

MDL Number (MFCD)

MFCD32220889

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.118

Distribution Coefficient, logD

4.118

Water Solubility, LogSw

-4.50

Polar Surface Area

37.212

Acid Dissociation Constant (pKa)

11.99

Base Dissociation Constant (pKb)

-3.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.43

References: we are preparing a list of scientific research reports with Y021-2757 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-2757?
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What is the minimum amount of Y021-2757 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-2757
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-2757
  • 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 Y021-2757 available by request