K284-5231 Screening compound: N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}butanamide

K284-5231 Screening compound: N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}butanamide
K284-5231 Screening compound: N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-5231
N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}butanamide

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

K284-5231

Molecular Formula

C24H28N4O4S (C24 H28 N4 O4 S)

Compound Name

N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}butanamide

IUPAC name

N-{3-[ethyl(phenyl)amino]propyl}-4-{8-oxo-6-sulfanylidene-2H5H6H7H8H-[13]dioxolo[45-g]quinazolin-7-yl}butanamide

SMILES

CCN(CCCNC(CCCN(C(c(cc1OCOc1c1)c1N1)=O)C1=S)=O)c1ccccc1

InChI

InChI=1S/C24H28N4O4S/c1-2-27(17-8-4-3-5-9-17)12-7-11-25-22(29)10-6-13-28-23(30)18-14-20-21(32-16-31-20)15-19(18)26-24(28)33/h3-5,8-9,14-15H,2,6-7,10-13,16H2,1H3,(H,25,29)(H,26,33)

InChI Key

HZMBJJGVSPDKLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08541280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.789

Distribution Coefficient, logD

2.738

Water Solubility, LogSw

-3.50

Polar Surface Area

71.715

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with K284-5231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-5231?
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What is the minimum amount of K284-5231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-5231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-5231
  • 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 K284-5231 available by request