K784-5020 Screening compound: 4-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one

K784-5020 Screening compound: 4-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one
K784-5020 Screening compound: 4-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-5020
4-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-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

K784-5020

Molecular Formula

C22H23N3O5 (C22 H23 N3 O5)

Compound Name

4-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one

IUPAC name

4-{14-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-4-hydroxy-3-phenyl-1234-tetrahydroquinazolin-2-one

SMILES

OC(C(N(CC1)CCC11OCCO1)=O)(c(cccc1)c1N1)N(c2ccccc2)C1=O

InChI

InChI=1S/C22H23N3O5/c26-19(24-12-10-21(11-13-24)29-14-15-30-21)22(28)17-8-4-5-9-18(17)23-20(27)25(22)16-6-2-1-3-7-16/h1-9,28H,10-15H2,(H,23,27)/t22-/m1/s1

InChI Key

GEUTYTAZLXABDF-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD05030350

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.788

Distribution Coefficient, logD

1.788

Water Solubility, LogSw

-2.61

Polar Surface Area

73.777

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

3.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

K784-5020 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K784-5020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-5020?
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What is the minimum amount of K784-5020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-5020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-5020
  • 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 K784-5020 available by request