F782-0789 Screening compound: 3-methyl-N-(2-propanamido-1,3-benzothiazol-5-yl)butanamide

F782-0789 Screening compound: 3-methyl-N-(2-propanamido-1,3-benzothiazol-5-yl)butanamide
F782-0789 Screening compound: 3-methyl-N-(2-propanamido-1,3-benzothiazol-5-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F782-0789
3-methyl-N-(2-propanamido-1,3-benzothiazol-5-yl)butanamide

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

F782-0789

Molecular Formula

C15H19N3O2S (C15 H19 N3 O2 S)

Compound Name

3-methyl-N-(2-propanamido-1,3-benzothiazol-5-yl)butanamide

IUPAC name

3-methyl-N-(2-propanamido-13-benzothiazol-5-yl)butanamide

SMILES

CCC(Nc1nc(cc(cc2)NC(CC(C)C)=O)c2s1)=O

InChI

InChI=1S/C15H19N3O2S/c1-4-13(19)18-15-17-11-8-10(5-6-12(11)21-15)16-14(20)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H,16,20)(H,17,18,19)

InChI Key

ULYVNGJVOFPZMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.473

Distribution Coefficient, logD

3.473

Water Solubility, LogSw

-3.77

Polar Surface Area

56.298

Acid Dissociation Constant (pKa)

10.47

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

F782-0789 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F782-0789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F782-0789?
Check Price and Availability of F782-0789, 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 F782-0789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F782-0789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F782-0789
  • 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 F782-0789 available by request