K284-5669 Screening compound: ethyl 2-{[7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}hexanoate

K284-5669 Screening compound: ethyl 2-{[7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}hexanoate
K284-5669 Screening compound: ethyl 2-{[7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}hexanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-5669
ethyl 2-{[7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}hexanoate

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

K284-5669

Molecular Formula

C31H39N3O8S (C31 H39 N3 O8 S)

Compound Name

ethyl 2-{[7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}hexanoate

IUPAC name

ethyl 2-{[7-(3-{[2-(34-dimethoxyphenyl)ethyl]carbamoyl}propyl)-8-oxo-2H7H8H-[13]dioxolo[45-g]quinazolin-6-yl]sulfanyl}hexanoate

SMILES

CCCCC(C(OCC)=O)SC(N1CCCC(NCCc(cc2)cc(OC)c2OC)=O)=Nc(cc2OCOc2c2)c2C1=O

InChI

InChI=1S/C31H39N3O8S/c1-5-7-9-27(30(37)40-6-2)43-31-33-22-18-26-25(41-19-42-26)17-21(22)29(36)34(31)15-8-10-28(35)32-14-13-20-11-12-23(38-3)24(16-20)39-4/h11-12,16-18,27H,5-10,13-15,19H2,1-4H3,(H,32,35)/t27-/m0/s1

InChI Key

QBGRKEWHAMEIRE-MHZLTWQESA-N

MDL Number (MFCD)

MFCD15088887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

613.73

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

4.232

Distribution Coefficient, logD

4.232

Water Solubility, LogSw

-4.23

Polar Surface Area

103.464

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

0.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.40

K284-5669 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K284-5669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-5669?
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What is the minimum amount of K284-5669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-5669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-5669
  • 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 K284-5669 available by request