C183-0060 Screening compound: 3-[(5-bromo-1-propanoyl-2,3-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-1-one

C183-0060 Screening compound: 3-[(5-bromo-1-propanoyl-2,3-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-1-one
C183-0060 Screening compound: 3-[(5-bromo-1-propanoyl-2,3-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C183-0060
3-[(5-bromo-1-propanoyl-2,3-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-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

C183-0060

Molecular Formula

C21H29BrN2O4S (C21 H29 BrN2 O4 S)

Compound Name

3-[(5-bromo-1-propanoyl-2,3-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-1-one

IUPAC name

3-[(5-bromo-1-propanoyl-23-dihydro-1H-indol-6-yl)sulfonyl]-1-(2-ethylpiperidin-1-yl)propan-1-one

SMILES

CCC(CCCC1)N1C(CCS(c(cc(c(CC1)c2)N1C(CC)=O)c2Br)(=O)=O)=O

InChI

InChI=1S/C21H29BrN2O4S/c1-3-16-7-5-6-10-23(16)21(26)9-12-29(27,28)19-14-18-15(13-17(19)22)8-11-24(18)20(25)4-2/h13-14,16H,3-12H2,1-2H3/t16-/m0/s1

InChI Key

SKGPKWBIKODHKJ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14724217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.226

Distribution Coefficient, logD

3.226

Water Solubility, LogSw

-3.57

Polar Surface Area

60.465

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

C183-0060 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C183-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C183-0060?
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What is the minimum amount of C183-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C183-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C183-0060
  • 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 C183-0060 available by request