K284-2511 Screening compound: ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate

K284-2511 Screening compound: ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
K284-2511 Screening compound: ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-2511
ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate

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

K284-2511

Molecular Formula

C23H22N4O4S (C23 H22 N4 O4 S)

Compound Name

ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate

IUPAC name

ethyl 2-({3-[3-(1H-indol-3-yl)propanamido]-4-oxo-34-dihydroquinazolin-2-yl}sulfanyl)acetate

SMILES

CCOC(CSC(N1NC(CCc2c[nH]c3c2cccc3)=O)=Nc(cccc2)c2C1=O)=O

InChI

InChI=1S/C23H22N4O4S/c1-2-31-21(29)14-32-23-25-19-10-6-4-8-17(19)22(30)27(23)26-20(28)12-11-15-13-24-18-9-5-3-7-16(15)18/h3-10,13,24H,2,11-12,14H2,1H3,(H,26,28)

InChI Key

AIBQMUBCRKMFIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024290

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.52

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

2.416

Distribution Coefficient, logD

2.416

Water Solubility, LogSw

-2.79

Polar Surface Area

82.260

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

-7.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

K284-2511 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 K284-2511 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-2511?
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What is the minimum amount of K284-2511 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-2511
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-2511
  • 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 K284-2511 available by request