C746-0733 Screening compound: 4-[(3-chlorophenyl)methyl]-3-(2-methylphenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

C746-0733 Screening compound: 4-[(3-chlorophenyl)methyl]-3-(2-methylphenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
C746-0733 Screening compound: 4-[(3-chlorophenyl)methyl]-3-(2-methylphenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C746-0733
4-[(3-chlorophenyl)methyl]-3-(2-methylphenyl)-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

C746-0733

Molecular Formula

C24H17ClN2OS2 (C24 H17 ClN2 OS2)

Compound Name

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

IUPAC name

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

SMILES

Cc(cccc1)c1C(SC(N1c2c3cccc2)=S)=C1N(Cc1cccc(Cl)c1)C3=O

InChI

InChI=1S/C24H17ClN2OS2/c1-15-7-2-3-10-18(15)21-22-26(14-16-8-6-9-17(25)13-16)23(28)19-11-4-5-12-20(19)27(22)24(29)30-21/h2-13H,14H2,1H3

InChI Key

FFKWLASPGPRHGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14791280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449

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

6.462

Distribution Coefficient, logD

6.462

Water Solubility, LogSw

-6.07

Polar Surface Area

17.788

Acid Dissociation Constant (pKa)

27.63

Base Dissociation Constant (pKb)

-5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with C746-0733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C746-0733?
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What is the minimum amount of C746-0733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C746-0733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C746-0733
  • 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 C746-0733 available by request