F782-1800 Screening compound: 2,4-dimethoxy-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]benzamide

F782-1800 Screening compound: 2,4-dimethoxy-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]benzamide
F782-1800 Screening compound: 2,4-dimethoxy-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F782-1800
2,4-dimethoxy-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-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

F782-1800

Molecular Formula

C20H21N3O4S (C20 H21 N3 O4 S)

Compound Name

2,4-dimethoxy-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]benzamide

IUPAC name

24-dimethoxy-N-[2-(2-methylpropanamido)-13-benzothiazol-5-yl]benzamide

SMILES

CC(C)C(Nc1nc(cc(cc2)NC(c(ccc(OC)c3)c3OC)=O)c2s1)=O

InChI

InChI=1S/C20H21N3O4S/c1-11(2)18(24)23-20-22-15-9-12(5-8-17(15)28-20)21-19(25)14-7-6-13(26-3)10-16(14)27-4/h5-11H,1-4H3,(H,21,25)(H,22,23,24)

InChI Key

QRMZFKBFVRAKNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.340

Distribution Coefficient, logD

4.296

Water Solubility, LogSw

-4.43

Polar Surface Area

71.628

Acid Dissociation Constant (pKa)

8.37

Base Dissociation Constant (pKb)

3.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F782-1800 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F782-1800 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F782-1800?
Check Price and Availability of F782-1800, 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 F782-1800 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F782-1800
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F782-1800
  • 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 F782-1800 available by request