K233-0929 Screening compound: 4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

K233-0929 Screening compound: 4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
K233-0929 Screening compound: 4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K233-0929
4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-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

K233-0929

Molecular Formula

C23H13Cl2FN2OS2 (C23 H13 Cl2 FN2 OS2)

Compound Name

4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

IUPAC name

4-[(2-chloro-4-fluorophenyl)methyl]-3-(3-chlorophenyl)-1-sulfanylidene-1H4H5H-[13]thiazolo[34-a]quinazolin-5-one

SMILES

O=C(c(cccc1)c1N12)N(Cc(ccc(F)c3)c3Cl)C2=C(c2cc(Cl)ccc2)SC1=S

InChI

InChI=1S/C23H13Cl2FN2OS2/c24-15-5-3-4-13(10-15)20-21-27(12-14-8-9-16(26)11-18(14)25)22(29)17-6-1-2-7-19(17)28(21)23(30)31-20/h1-11H,12H2

InChI Key

ODLYBJLMCLXWNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15083319

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.935

Distribution Coefficient, logD

6.935

Water Solubility, LogSw

-6.50

Polar Surface Area

17.788

Acid Dissociation Constant (pKa)

29.76

Base Dissociation Constant (pKb)

-6.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with K233-0929 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K233-0929?
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What is the minimum amount of K233-0929 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K233-0929
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K233-0929
  • 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 K233-0929 available by request