C760-1077 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

C760-1077 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide
C760-1077 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-1077
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]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

C760-1077

Molecular Formula

C24H33N3OS (C24 H33 N3 OS)

Compound Name

N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

IUPAC name

N-{2-[4-(23-dimethylphenyl)piperazin-1-yl]ethyl}-4H5H6H7H8H-cyclohepta[b]thiophene-3-carboxamide

SMILES

Cc1cccc(N2CCN(CCNC(c3csc4c3CCCCC4)=O)CC2)c1C

InChI

InChI=1S/C24H33N3OS/c1-18-7-6-9-22(19(18)2)27-15-13-26(14-16-27)12-11-25-24(28)21-17-29-23-10-5-3-4-8-20(21)23/h6-7,9,17H,3-5,8,10-16H2,1-2H3,(H,25,28)

InChI Key

HEIXNSGZDRHZQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.61

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.415

Distribution Coefficient, logD

5.302

Water Solubility, LogSw

-5.14

Polar Surface Area

32.705

Acid Dissociation Constant (pKa)

13.13

Base Dissociation Constant (pKb)

6.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.20

C760-1077 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C760-1077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-1077?
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What is the minimum amount of C760-1077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-1077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-1077
  • 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 C760-1077 available by request