K284-2519 Screening compound: N-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}-3-(1H-indol-3-yl)propanamide

K284-2519 Screening compound: N-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}-3-(1H-indol-3-yl)propanamide
K284-2519 Screening compound: N-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}-3-(1H-indol-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-2519
N-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}-3-(1H-indol-3-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

K284-2519

Molecular Formula

C31H31N5O5S (C31 H31 N5 O5 S)

Compound Name

N-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}-3-(1H-indol-3-yl)propanamide

IUPAC name

N-{2-[({[2-(34-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-34-dihydroquinazolin-3-yl}-3-(1H-indol-3-yl)propanamide

SMILES

COc(ccc(CCNC(CSC(N1NC(CCc2c[nH]c3c2cccc3)=O)=Nc(cccc2)c2C1=O)=O)c1)c1OC

InChI

InChI=1S/C31H31N5O5S/c1-40-26-13-11-20(17-27(26)41-2)15-16-32-29(38)19-42-31-34-25-10-6-4-8-23(25)30(39)36(31)35-28(37)14-12-21-18-33-24-9-5-3-7-22(21)24/h3-11,13,17-18,33H,12,14-16,19H2,1-2H3,(H,32,38)(H,35,37)

InChI Key

BXHJINWQZQKSBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

585.68

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.178

Distribution Coefficient, logD

2.178

Water Solubility, LogSw

-2.90

Polar Surface Area

101.403

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.60

K284-2519 in Drug Discovery

Included in Screening Libraries

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K284-2519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-2519?
Check Price and Availability of K284-2519, 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 K284-2519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-2519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-2519
  • 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 K284-2519 available by request