K232-1791 Screening compound: 3-{2-[(4-acetylphenyl)amino]-5-methyl-1,3-thiazol-4-yl}-8-methoxy-2H-chromen-2-one

K232-1791 Screening compound: 3-{2-[(4-acetylphenyl)amino]-5-methyl-1,3-thiazol-4-yl}-8-methoxy-2H-chromen-2-one
K232-1791 Screening compound: 3-{2-[(4-acetylphenyl)amino]-5-methyl-1,3-thiazol-4-yl}-8-methoxy-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K232-1791
3-{2-[(4-acetylphenyl)amino]-5-methyl-1,3-thiazol-4-yl}-8-methoxy-2H-chromen-2-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

K232-1791

Molecular Formula

C22H18N2O4S (C22 H18 N2 O4 S)

Compound Name

3-{2-[(4-acetylphenyl)amino]-5-methyl-1,3-thiazol-4-yl}-8-methoxy-2H-chromen-2-one

IUPAC name

3-{2-[(4-acetylphenyl)amino]-5-methyl-13-thiazol-4-yl}-8-methoxy-2H-chromen-2-one

SMILES

CC(c(cc1)ccc1Nc1nc(C2=Cc(cccc3OC)c3OC2=O)c(C)s1)=O

InChI

InChI=1S/C22H18N2O4S/c1-12(25)14-7-9-16(10-8-14)23-22-24-19(13(2)29-22)17-11-15-5-4-6-18(27-3)20(15)28-21(17)26/h4-11H,1-3H3,(H,23,24)

InChI Key

WQGLSNWINWXJCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15083132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.450

Distribution Coefficient, logD

4.450

Water Solubility, LogSw

-4.49

Polar Surface Area

61.759

Acid Dissociation Constant (pKa)

15.00

Base Dissociation Constant (pKb)

-0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

K232-1791 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K232-1791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K232-1791?
Check Price and Availability of K232-1791, 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 K232-1791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K232-1791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K232-1791
  • 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 K232-1791 available by request