K284-5311 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}propanamide

K284-5311 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}propanamide
K284-5311 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-5311
N-{3-[benzyl(methyl)amino]propyl}-3-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}propanamide

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

K284-5311

Molecular Formula

C23H26N4O4S (C23 H26 N4 O4 S)

Compound Name

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

IUPAC name

N-{3-[benzyl(methyl)amino]propyl}-3-{8-oxo-6-sulfanylidene-2H5H6H7H8H-[13]dioxolo[45-g]quinazolin-7-yl}propanamide

SMILES

CN(CCCNC(CCN(C(c(cc1OCOc1c1)c1N1)=O)C1=S)=O)Cc1ccccc1

InChI

InChI=1S/C23H26N4O4S/c1-26(14-16-6-3-2-4-7-16)10-5-9-24-21(28)8-11-27-22(29)17-12-19-20(31-15-30-19)13-18(17)25-23(27)32/h2-4,6-7,12-13H,5,8-11,14-15H2,1H3,(H,24,28)(H,25,32)

InChI Key

AIEFEDYVAOFWQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15088685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.227

Distribution Coefficient, logD

0.730

Water Solubility, LogSw

-3.26

Polar Surface Area

72.819

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with K284-5311 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-5311?
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What is the minimum amount of K284-5311 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-5311
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-5311
  • 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 K284-5311 available by request