G585-1441 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-3-carboxamide

G585-1441 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-3-carboxamide
G585-1441 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G585-1441
1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-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

G585-1441

Molecular Formula

C22H33N3O3S2 (C22 H33 N3 O3 S2)

Compound Name

1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-3-carboxamide

IUPAC name

1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-[3-(propylsulfanyl)propyl]piperidine-3-carboxamide

SMILES

CCCSCCCNC(C(CCC1)CN1S(c(cc1)cc2c1n(CC)cc2)(=O)=O)=O

InChI

InChI=1S/C22H33N3O3S2/c1-3-14-29-15-6-11-23-22(26)19-7-5-12-25(17-19)30(27,28)20-8-9-21-18(16-20)10-13-24(21)4-2/h8-10,13,16,19H,3-7,11-12,14-15,17H2,1-2H3,(H,23,26)/t19-/m0/s1

InChI Key

VMXVXUIRSHNPDB-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27145060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.992

Distribution Coefficient, logD

2.992

Water Solubility, LogSw

-3.36

Polar Surface Area

58.245

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

59.09

G585-1441 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G585-1441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G585-1441?
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What is the minimum amount of G585-1441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G585-1441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G585-1441
  • 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 G585-1441 available by request