F690-0820 Screening compound: methyl 4-{[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]amino}benzoate

F690-0820 Screening compound: methyl 4-{[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]amino}benzoate
F690-0820 Screening compound: methyl 4-{[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F690-0820
methyl 4-{[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]amino}benzoate

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

F690-0820

Molecular Formula

C24H20N4O5S (C24 H20 N4 O5 S)

Compound Name

methyl 4-{[(2-benzamido-4-methoxy-1,3-benzothiazol-6-yl)carbamoyl]amino}benzoate

IUPAC name

methyl 4-{[(2-benzamido-4-methoxy-13-benzothiazol-6-yl)carbamoyl]amino}benzoate

SMILES

COC(c(cc1)ccc1NC(Nc(cc1OC)cc2c1nc(NC(c1ccccc1)=O)s2)=O)=O

InChI

InChI=1S/C24H20N4O5S/c1-32-18-12-17(26-23(31)25-16-10-8-15(9-11-16)22(30)33-2)13-19-20(18)27-24(34-19)28-21(29)14-6-4-3-5-7-14/h3-13H,1-2H3,(H2,25,26,31)(H,27,28,29)

InChI Key

JYBIKSZFYXAONS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14963597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.213

Distribution Coefficient, logD

5.211

Water Solubility, LogSw

-5.16

Polar Surface Area

94.969

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

F690-0820 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F690-0820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F690-0820?
Check Price and Availability of F690-0820, 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 F690-0820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F690-0820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F690-0820
  • 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 F690-0820 available by request