K288-0035 Screening compound: 2-[4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl]-N~1~-(tetrahydro-2-furanylmethyl)acetamide

K288-0035 Screening compound: 2-[4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl]-N~1~-(tetrahydro-2-furanylmethyl)acetamide
K288-0035 Screening compound: 2-[4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl]-N~1~-(tetrahydro-2-furanylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K288-0035
2-[4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl]-N~1~-(tetrahydro-2-furanylmethyl)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

K288-0035

Molecular Formula

C15H17N3O3S (C15 H17 N3 O3 S)

Compound Name

2-[4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl]-N~1~-(tetrahydro-2-furanylmethyl)acetamide

IUPAC name

2-(4-oxo-2-sulfanylidene-1234-tetrahydroquinazolin-3-yl)-N-[(oxolan-2-yl)methyl]acetamide

SMILES

O=C(CN(C(c(cccc1)c1N1)=O)C1=S)NCC1OCCC1

InChI

InChI=1S/C15H17N3O3S/c19-13(16-8-10-4-3-7-21-10)9-18-14(20)11-5-1-2-6-12(11)17-15(18)22/h1-2,5-6,10H,3-4,7-9H2,(H,16,19)(H,17,22)/t10-/m1/s1

InChI Key

LINMRCJYUMUGQW-SNVBAGLBSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.898

Distribution Coefficient, logD

0.898

Water Solubility, LogSw

-2.44

Polar Surface Area

60.444

Acid Dissociation Constant (pKa)

10.26

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

K288-0035 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K288-0035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K288-0035?
Check Price and Availability of K288-0035, 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 K288-0035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K288-0035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K288-0035
  • 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 K288-0035 available by request