K287-0211 Screening compound: 3-(sec-butyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

K287-0211 Screening compound: 3-(sec-butyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone
K287-0211 Screening compound: 3-(sec-butyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound K287-0211
3-(sec-butyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

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

K287-0211

Molecular Formula

C12H14N2OS (C12 H14 N2 OS)

Compound Name

3-(sec-butyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

IUPAC name

3-(butan-2-yl)-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

CCC(C)N(C(c(cccc1)c1N1)=O)C1=S

InChI

InChI=1S/C12H14N2OS/c1-3-8(2)14-11(15)9-6-4-5-7-10(9)13-12(14)16/h4-8H,3H2,1-2H3,(H,13,16)/t8-/m0/s1

InChI Key

QHFSMCPUFWXIQC-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD02675209

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.020

Distribution Coefficient, logD

3.019

Water Solubility, LogSw

-3.53

Polar Surface Area

26.895

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

-7.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.33

K287-0211 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K287-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K287-0211?
Check Price and Availability of K287-0211, 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 K287-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K287-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K287-0211
  • 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 K287-0211 available by request