G008-3117 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

G008-3117 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide
G008-3117 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-3117
N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

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

G008-3117

Molecular Formula

C16H21F3N4O3S2 (C16 H21 F3 N4 O3 S2)

Compound Name

N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide

IUPAC name

N-[3-(4-methylpiperazin-1-yl)propyl]-5-[5-(trifluoromethyl)-12-oxazol-3-yl]thiophene-2-sulfonamide

SMILES

CN1CCN(CCCNS(c2ccc(-c3noc(C(F)(F)F)c3)s2)(=O)=O)CC1

InChI

InChI=1S/C16H21F3N4O3S2/c1-22-7-9-23(10-8-22)6-2-5-20-28(24,25)15-4-3-13(27-15)12-11-14(26-21-12)16(17,18)19/h3-4,11,20H,2,5-10H2,1H3

InChI Key

SYCOOTXFBYEWOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14975637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.468

Distribution Coefficient, logD

1.654

Water Solubility, LogSw

-2.93

Polar Surface Area

71.851

Acid Dissociation Constant (pKa)

10.15

Base Dissociation Constant (pKb)

8.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

G008-3117 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • 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 G008-3117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-3117?
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What is the minimum amount of G008-3117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-3117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-3117
  • 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 G008-3117 available by request