8017-6430 Screening compound: N-{1-[2-(diethylamino)ethyl]-1H-1,3-benzimidazol-5-yl}-4-fluoro-1-benzenesulfonamide

8017-6430 Screening compound: N-{1-[2-(diethylamino)ethyl]-1H-1,3-benzimidazol-5-yl}-4-fluoro-1-benzenesulfonamide
8017-6430 Screening compound: N-{1-[2-(diethylamino)ethyl]-1H-1,3-benzimidazol-5-yl}-4-fluoro-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-6430
N-{1-[2-(diethylamino)ethyl]-1H-1,3-benzimidazol-5-yl}-4-fluoro-1-benzenesulfonamide

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

8017-6430

Molecular Formula

C19H23FN4O2S (C19 H23 FN4 O2 S)

Compound Name

N-{1-[2-(diethylamino)ethyl]-1H-1,3-benzimidazol-5-yl}-4-fluoro-1-benzenesulfonamide

IUPAC name

N-{1-[2-(diethylamino)ethyl]-1H-13-benzodiazol-5-yl}-4-fluorobenzene-1-sulfonamide

SMILES

CCN(CC)CCn1c(ccc(NS(c(cc2)ccc2F)(=O)=O)c2)c2nc1

InChI

InChI=1S/C19H23FN4O2S/c1-3-23(4-2)11-12-24-14-21-18-13-16(7-10-19(18)24)22-27(25,26)17-8-5-15(20)6-9-17/h5-10,13-14,22H,3-4,11-12H2,1-2H3

InChI Key

DFABQUSTOKTHRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06617121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.048

Distribution Coefficient, logD

2.298

Water Solubility, LogSw

-3.38

Polar Surface Area

54.734

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

8017-6430 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8017-6430 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-6430?
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What is the minimum amount of 8017-6430 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-6430
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-6430
  • 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 8017-6430 available by request