G949-4057 Screening compound: 1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide

G949-4057 Screening compound: 1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
G949-4057 Screening compound: 1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G949-4057
1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]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

G949-4057

Molecular Formula

C23H26N4O4S2 (C23 H26 N4 O4 S2)

Compound Name

1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide

IUPAC name

1-[2-methyl-5-(5-methyl-124-oxadiazol-3-yl)benzenesulfonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide

SMILES

Cc1nc(-c2cc(S(N(CCC3)CC3C(Nc3cc(SC)ccc3)=O)(=O)=O)c(C)cc2)no1

InChI

InChI=1S/C23H26N4O4S2/c1-15-9-10-17(22-24-16(2)31-26-22)12-21(15)33(29,30)27-11-5-6-18(14-27)23(28)25-19-7-4-8-20(13-19)32-3/h4,7-10,12-13,18H,5-6,11,14H2,1-3H3,(H,25,28)/t18-/m0/s1

InChI Key

HFPRKVHIWOPPKP-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15077225

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.974

Distribution Coefficient, logD

3.974

Water Solubility, LogSw

-3.97

Polar Surface Area

85.879

Acid Dissociation Constant (pKa)

11.27

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

G949-4057 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G949-4057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G949-4057?
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What is the minimum amount of G949-4057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G949-4057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G949-4057
  • 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 G949-4057 available by request