Y020-7837 Screening compound: 6',6'-dimethyl-5',6'-dihydro-1''H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',2''-quinazoline]-2',4''(3''H)-dione

Y020-7837 Screening compound: 6',6'-dimethyl-5',6'-dihydro-1''H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',2''-quinazoline]-2',4''(3''H)-dione
Y020-7837 Screening compound: 6',6'-dimethyl-5',6'-dihydro-1''H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',2''-quinazoline]-2',4''(3''H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-7837
6',6'-dimethyl-5',6'-dihydro-1''H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',2''-quinazoline]-2',4''(3''H)-dione

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

Y020-7837

Molecular Formula

C25H27N3O2 (C25 H27 N3 O2)

Compound Name

6',6'-dimethyl-5',6'-dihydro-1''H-dispiro[cyclohexane-1,4'-pyrrolo[3,2,1-ij]quinoline-1',2''-quinazoline]-2',4''(3''H)-dione

IUPAC name

7'7'-dimethyl-3''4''-dihydro-1''H-dispiro[cyclohexane-15'-[4]azatricyclo[6.3.1.0^{412}]dodecane-2'2''-quinazoline]-1'(11')8'(12')9'-triene-3'4''-dione

SMILES

CC(C)(CC12CCCCC2)c2cccc(C3(Nc4c5cccc4)NC5=O)c2N1C3=O

InChI

InChI=1S/C25H27N3O2/c1-23(2)15-24(13-6-3-7-14-24)28-20-17(23)10-8-11-18(20)25(22(28)30)26-19-12-5-4-9-16(19)21(29)27-25/h4-5,8-12,26H,3,6-7,13-15H2,1-2H3,(H,27,29)/t25-/m0/s1

InChI Key

OMXOSYZZGWWQCD-VWLOTQADSA-N

MDL Number (MFCD)

MFCD08087984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.440

Distribution Coefficient, logD

4.436

Water Solubility, LogSw

-4.38

Polar Surface Area

53.919

Acid Dissociation Constant (pKa)

9.44

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

Y020-7837 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with Y020-7837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-7837?
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What is the minimum amount of Y020-7837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-7837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-7837
  • 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 Y020-7837 available by request