K288-0196 Screening compound: 3-(7-chloro-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide

K288-0196 Screening compound: 3-(7-chloro-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide
K288-0196 Screening compound: 3-(7-chloro-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K288-0196
3-(7-chloro-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide

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

K288-0196

Molecular Formula

C18H16ClN3O2S (C18 H16 ClN3 O2 S)

Compound Name

3-(7-chloro-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide

IUPAC name

3-(7-chloro-4-oxo-2-sulfanylidene-1234-tetrahydroquinazolin-3-yl)-N-(propan-2-yl)benzamide

SMILES

CC(C)NC(c1cccc(N(C(c(ccc(Cl)c2)c2N2)=O)C2=S)c1)=O

InChI

InChI=1S/C18H16ClN3O2S/c1-10(2)20-16(23)11-4-3-5-13(8-11)22-17(24)14-7-6-12(19)9-15(14)21-18(22)25/h3-10H,1-2H3,(H,20,23)(H,21,25)

InChI Key

JTLWRYOTSVUYGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024893

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.128

Distribution Coefficient, logD

2.751

Water Solubility, LogSw

-3.83

Polar Surface Area

50.365

Acid Dissociation Constant (pKa)

7.26

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

K288-0196 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with K288-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K288-0196?
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What is the minimum amount of K288-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K288-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K288-0196
  • 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 K288-0196 available by request