K284-4896 Screening compound: 2-{[3-(4-methylbenzenesulfonamido)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

K284-4896 Screening compound: 2-{[3-(4-methylbenzenesulfonamido)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
K284-4896 Screening compound: 2-{[3-(4-methylbenzenesulfonamido)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-4896
2-{[3-(4-methylbenzenesulfonamido)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

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

K284-4896

Molecular Formula

C25H24N4O4S2 (C25 H24 N4 O4 S2)

Compound Name

2-{[3-(4-methylbenzenesulfonamido)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

IUPAC name

2-{[3-(4-methylbenzenesulfonamido)-4-oxo-34-dihydroquinazolin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide

SMILES

Cc(cc1)ccc1S(NN1C(SCC(NCCc2ccccc2)=O)=Nc(cccc2)c2C1=O)(=O)=O

InChI

InChI=1S/C25H24N4O4S2/c1-18-11-13-20(14-12-18)35(32,33)28-29-24(31)21-9-5-6-10-22(21)27-25(29)34-17-23(30)26-16-15-19-7-3-2-4-8-19/h2-14,28H,15-17H2,1H3,(H,26,30)

InChI Key

KHRAYIRFHQNBSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15088567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.458

Distribution Coefficient, logD

2.457

Water Solubility, LogSw

-3.09

Polar Surface Area

92.172

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

K284-4896 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K284-4896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-4896?
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What is the minimum amount of K284-4896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-4896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-4896
  • 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 K284-4896 available by request