G541-0607 Screening compound: 1,8-dimethyl-N,N-dipropyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

G541-0607 Screening compound: 1,8-dimethyl-N,N-dipropyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide
G541-0607 Screening compound: 1,8-dimethyl-N,N-dipropyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G541-0607
1,8-dimethyl-N,N-dipropyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

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

G541-0607

Molecular Formula

C19H25N3OS (C19 H25 N3 OS)

Compound Name

1,8-dimethyl-N,N-dipropyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

IUPAC name

18-dimethyl-NN-dipropyl-1H4H-thiochromeno[43-c]pyrazole-3-carboxamide

SMILES

CCCN(CCC)C(c1nn(C)c-2c1CSc1c2cc(C)cc1)=O

InChI

InChI=1S/C19H25N3OS/c1-5-9-22(10-6-2)19(23)17-15-12-24-16-8-7-13(3)11-14(16)18(15)21(4)20-17/h7-8,11H,5-6,9-10,12H2,1-4H3

InChI Key

MXICTKSQEBOFNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15017676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.884

Distribution Coefficient, logD

3.884

Water Solubility, LogSw

-3.88

Polar Surface Area

31.001

Acid Dissociation Constant (pKa)

19.18

Base Dissociation Constant (pKb)

-1.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

G541-0607 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with G541-0607 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G541-0607?
Check Price and Availability of G541-0607, 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 G541-0607 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G541-0607
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G541-0607
  • 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 G541-0607 available by request