Y042-9212 Screening compound: 6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

Y042-9212 Screening compound: 6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H,2H,3H,4H-cyclopenta[c]chromen-4-one
Y042-9212 Screening compound: 6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H,2H,3H,4H-cyclopenta[c]chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y042-9212
6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H,2H,3H,4H-cyclopenta[c]chromen-4-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

Y042-9212

Molecular Formula

C25H25NO4 (C25 H25 NO4)

Compound Name

6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

IUPAC name

6-methyl-7-{2-oxo-2-[4-(pyrrolidin-1-yl)phenyl]ethoxy}-1H2H3H4H-cyclopenta[c]chromen-4-one

SMILES

Cc(c(O1)c(cc2)C(CCC3)=C3C1=O)c2OCC(c(cc1)ccc1N1CCCC1)=O

InChI

InChI=1S/C25H25NO4/c1-16-23(12-11-20-19-5-4-6-21(19)25(28)30-24(16)20)29-15-22(27)17-7-9-18(10-8-17)26-13-2-3-14-26/h7-12H,2-6,13-15H2,1H3

InChI Key

GAWHTZDVEAWRCK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.559

Distribution Coefficient, logD

4.559

Water Solubility, LogSw

-4.40

Polar Surface Area

45.511

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

9.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with Y042-9212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y042-9212?
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What is the minimum amount of Y042-9212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y042-9212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y042-9212
  • 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 Y042-9212 available by request