E629-1708 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide

E629-1708 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide
E629-1708 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E629-1708
2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide

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

E629-1708

Molecular Formula

C21H23ClN2OS (C21 H23 ClN2 OS)

Compound Name

2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide

IUPAC name

2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-cycloheptylacetamide

SMILES

O=C(Cn(c(-c1cccs1)c1)c(cc2)c1cc2Cl)NC1CCCCCC1

InChI

InChI=1S/C21H23ClN2OS/c22-16-9-10-18-15(12-16)13-19(20-8-5-11-26-20)24(18)14-21(25)23-17-6-3-1-2-4-7-17/h5,8-13,17H,1-4,6-7,14H2,(H,23,25)

InChI Key

VJBQFCXNBUTNHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27600763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.95

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.279

Distribution Coefficient, logD

6.279

Water Solubility, LogSw

-6.34

Polar Surface Area

25.967

Acid Dissociation Constant (pKa)

14.61

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

E629-1708 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E629-1708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E629-1708?
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What is the minimum amount of E629-1708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E629-1708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E629-1708
  • 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 E629-1708 available by request