C607-0809 Screening compound: 1-(2,3-dihydro-1H-indol-5-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethan-1-one

C607-0809 Screening compound: 1-(2,3-dihydro-1H-indol-5-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethan-1-one
C607-0809 Screening compound: 1-(2,3-dihydro-1H-indol-5-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C607-0809
1-(2,3-dihydro-1H-indol-5-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethan-1-one

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

C607-0809

Molecular Formula

C22H27N3O (C22 H27 N3 O)

Compound Name

1-(2,3-dihydro-1H-indol-5-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethan-1-one

IUPAC name

1-(23-dihydro-1H-indol-5-yl)-2-[4-(23-dimethylphenyl)piperazin-1-yl]ethan-1-one

SMILES

Cc1cccc(N2CCN(CC(c(cc3)cc4c3NCC4)=O)CC2)c1C

InChI

InChI=1S/C22H27N3O/c1-16-4-3-5-21(17(16)2)25-12-10-24(11-13-25)15-22(26)19-6-7-20-18(14-19)8-9-23-20/h3-7,14,23H,8-13,15H2,1-2H3

InChI Key

UGRHTVBLRLOCEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.079

Distribution Coefficient, logD

4.055

Water Solubility, LogSw

-4.13

Polar Surface Area

32.022

Acid Dissociation Constant (pKa)

19.02

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

C607-0809 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS BBB Library (22607 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with C607-0809 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C607-0809?
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What is the minimum amount of C607-0809 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C607-0809
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C607-0809
  • 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 C607-0809 available by request