C760-1068 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

C760-1068 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide
C760-1068 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-1068
N-{2-[ethyl(phenyl)amino]ethyl}-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

C760-1068

Molecular Formula

C20H26N2OS (C20 H26 N2 OS)

Compound Name

N-{2-[ethyl(phenyl)amino]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

IUPAC name

N-{2-[ethyl(phenyl)amino]ethyl}-4H5H6H7H8H-cyclohepta[b]thiophene-3-carboxamide

SMILES

CCN(CCNC(c1csc2c1CCCCC2)=O)c1ccccc1

InChI

InChI=1S/C20H26N2OS/c1-2-22(16-9-5-3-6-10-16)14-13-21-20(23)18-15-24-19-12-8-4-7-11-17(18)19/h3,5-6,9-10,15H,2,4,7-8,11-14H2,1H3,(H,21,23)

InChI Key

RIHUZTWCPCILHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792069

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.51

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.886

Distribution Coefficient, logD

4.885

Water Solubility, LogSw

-4.46

Polar Surface Area

28.753

Acid Dissociation Constant (pKa)

14.05

Base Dissociation Constant (pKb)

7.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C760-1068 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C760-1068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-1068?
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What is the minimum amount of C760-1068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-1068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-1068
  • 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 C760-1068 available by request