8610-0509 Screening compound: N-(2-{[2-(4-ethylpiperazin-1-yl)-3,5,6-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline

8610-0509 Screening compound: N-(2-{[2-(4-ethylpiperazin-1-yl)-3,5,6-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline
8610-0509 Screening compound: N-(2-{[2-(4-ethylpiperazin-1-yl)-3,5,6-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8610-0509
N-(2-{[2-(4-ethylpiperazin-1-yl)-3,5,6-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline

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

8610-0509

Molecular Formula

C19H23F3N4O2S (C19 H23 F3 N4 O2 S)

Compound Name

N-(2-{[2-(4-ethylpiperazin-1-yl)-3,5,6-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline

IUPAC name

N-(2-{[2-(4-ethylpiperazin-1-yl)-356-trifluoropyridin-4-yl]sulfonyl}ethyl)aniline

SMILES

CCN(CC1)CCN1c(nc(c(F)c1S(CCNc2ccccc2)(=O)=O)F)c1F

InChI

InChI=1S/C19H23F3N4O2S/c1-2-25-9-11-26(12-10-25)19-16(21)17(15(20)18(22)24-19)29(27,28)13-8-23-14-6-4-3-5-7-14/h3-7,23H,2,8-13H2,1H3

InChI Key

PMFVBQNOWQFRQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08053748

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.007

Distribution Coefficient, logD

2.600

Water Solubility, LogSw

-3.28

Polar Surface Area

57.541

Acid Dissociation Constant (pKa)

20.92

Base Dissociation Constant (pKb)

7.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

8610-0509 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8610-0509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8610-0509?
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What is the minimum amount of 8610-0509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8610-0509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8610-0509
  • 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 8610-0509 available by request