K284-2386 Screening compound: 3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

K284-2386 Screening compound: 3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one
K284-2386 Screening compound: 3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-2386
3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

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

K284-2386

Molecular Formula

C16H19N3O2S (C16 H19 N3 O2 S)

Compound Name

3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

O=C(CCCN(C(c(cccc1)c1N1)=O)C1=S)N1CCCC1

InChI

InChI=1S/C16H19N3O2S/c20-14(18-9-3-4-10-18)8-5-11-19-15(21)12-6-1-2-7-13(12)17-16(19)22/h1-2,6-7H,3-5,8-11H2,(H,17,22)

InChI Key

VIBRAMRXUJLYPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.835

Distribution Coefficient, logD

1.834

Water Solubility, LogSw

-2.59

Polar Surface Area

44.055

Acid Dissociation Constant (pKa)

9.99

Base Dissociation Constant (pKb)

-0.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

K284-2386 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K284-2386 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-2386?
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What is the minimum amount of K284-2386 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-2386
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-2386
  • 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 K284-2386 available by request