G017-4157 Screening compound: 4-({[4-(methylsulfanyl)phenethyl]amino}sulfonyl)-2-thiophenecarboxamide

G017-4157 Screening compound: 4-({[4-(methylsulfanyl)phenethyl]amino}sulfonyl)-2-thiophenecarboxamide
G017-4157 Screening compound: 4-({[4-(methylsulfanyl)phenethyl]amino}sulfonyl)-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G017-4157
4-({[4-(methylsulfanyl)phenethyl]amino}sulfonyl)-2-thiophenecarboxamide

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

G017-4157

Molecular Formula

C14H16N2O3S3 (C14 H16 N2 O3 S3)

Compound Name

4-({[4-(methylsulfanyl)phenethyl]amino}sulfonyl)-2-thiophenecarboxamide

IUPAC name

n/a

SMILES

CSc1ccc(CCNS(c2csc(C(N)=O)c2)(=O)=O)cc1

InChI

InChI=1S/C14H16N2O3S3/c1-20-11-4-2-10(3-5-11)6-7-16-22(18,19)12-8-13(14(15)17)21-9-12/h2-5,8-9,16H,6-7H2,1H3,(H2,15,17)

InChI Key

YHJIZZBKKWMDJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14977464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.377

Distribution Coefficient, logD

2.376

Water Solubility, LogSw

-2.90

Polar Surface Area

76.915

Acid Dissociation Constant (pKa)

11.35

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

G017-4157 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G017-4157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G017-4157?
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What is the minimum amount of G017-4157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G017-4157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G017-4157
  • 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 G017-4157 available by request