K284-3727 Screening compound: 3-(2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(2-phenylethyl)propanamide

K284-3727 Screening compound: 3-(2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(2-phenylethyl)propanamide
K284-3727 Screening compound: 3-(2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(2-phenylethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-3727
3-(2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(2-phenylethyl)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

K284-3727

Molecular Formula

C28H29N3O2S (C28 H29 N3 O2 S)

Compound Name

3-(2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(2-phenylethyl)propanamide

IUPAC name

3-(2-{[(24-dimethylphenyl)methyl]sulfanyl}-4-oxo-34-dihydroquinazolin-3-yl)-N-(2-phenylethyl)propanamide

SMILES

Cc1cc(C)c(CSC(N2CCC(NCCc3ccccc3)=O)=Nc(cccc3)c3C2=O)cc1

InChI

InChI=1S/C28H29N3O2S/c1-20-12-13-23(21(2)18-20)19-34-28-30-25-11-7-6-10-24(25)27(33)31(28)17-15-26(32)29-16-14-22-8-4-3-5-9-22/h3-13,18H,14-17,19H2,1-2H3,(H,29,32)

InChI Key

UNIVILNESXJTQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15087920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.774

Distribution Coefficient, logD

4.774

Water Solubility, LogSw

-4.43

Polar Surface Area

50.062

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

K284-3727 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K284-3727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-3727?
Check Price and Availability of K284-3727, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K284-3727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-3727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-3727
  • 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 K284-3727 available by request