C760-1037 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

C760-1037 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide
C760-1037 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-1037
N-{3-[butyl(ethyl)amino]propyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-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

C760-1037

Molecular Formula

C19H32N2OS (C19 H32 N2 OS)

Compound Name

N-{3-[butyl(ethyl)amino]propyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

IUPAC name

N-{3-[butyl(ethyl)amino]propyl}-4H5H6H7H8H-cyclohepta[b]thiophene-3-carboxamide

SMILES

CCCCN(CC)CCCNC(c1csc2c1CCCCC2)=O

InChI

InChI=1S/C19H32N2OS/c1-3-5-13-21(4-2)14-9-12-20-19(22)17-15-23-18-11-8-6-7-10-16(17)18/h15H,3-14H2,1-2H3,(H,20,22)

InChI Key

CZRWBCTYEUGMBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.649

Distribution Coefficient, logD

1.956

Water Solubility, LogSw

-4.17

Polar Surface Area

29.700

Acid Dissociation Constant (pKa)

14.85

Base Dissociation Constant (pKb)

10.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

73.70

C760-1037 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C760-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-1037?
Check Price and Availability of C760-1037, 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 C760-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-1037
  • 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 C760-1037 available by request