G585-1698 Screening compound: N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide

G585-1698 Screening compound: N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide
G585-1698 Screening compound: N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G585-1698
N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]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

G585-1698

Molecular Formula

C22H24BrN3O3S (C22 H24 BrN3 O3 S)

Compound Name

N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide

IUPAC name

N-[(3-bromophenyl)methyl]-1-[(1-methyl-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide

SMILES

Cn(cc1)c(cc2)c1cc2S(N(CCC1)CC1C(NCc1cccc(Br)c1)=O)(=O)=O

InChI

InChI=1S/C22H24BrN3O3S/c1-25-11-9-17-13-20(7-8-21(17)25)30(28,29)26-10-3-5-18(15-26)22(27)24-14-16-4-2-6-19(23)12-16/h2,4,6-9,11-13,18H,3,5,10,14-15H2,1H3,(H,24,27)/t18-/m0/s1

InChI Key

NDUUXBGBMSIQDS-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15021075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.310

Distribution Coefficient, logD

3.310

Water Solubility, LogSw

-3.68

Polar Surface Area

58.963

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

G585-1698 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Epigenetic
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G585-1698 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G585-1698?
Check Price and Availability of G585-1698, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G585-1698 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G585-1698
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G585-1698
  • 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 G585-1698 available by request