F485-0563 Screening compound: 2-chloro-N-[2-(2-phenyl-1H-1,3-benzodiazol-1-yl)ethyl]benzene-1-sulfonamide

F485-0563 Screening compound: 2-chloro-N-[2-(2-phenyl-1H-1,3-benzodiazol-1-yl)ethyl]benzene-1-sulfonamide
F485-0563 Screening compound: 2-chloro-N-[2-(2-phenyl-1H-1,3-benzodiazol-1-yl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F485-0563
2-chloro-N-[2-(2-phenyl-1H-1,3-benzodiazol-1-yl)ethyl]benzene-1-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

F485-0563

Molecular Formula

C21H18ClN3O2S (C21 H18 ClN3 O2 S)

Compound Name

2-chloro-N-[2-(2-phenyl-1H-1,3-benzodiazol-1-yl)ethyl]benzene-1-sulfonamide

IUPAC name

2-chloro-N-[2-(2-phenyl-1H-13-benzodiazol-1-yl)ethyl]benzene-1-sulfonamide

SMILES

O=S(c(cccc1)c1Cl)(NCCn1c(-c2ccccc2)nc2c1cccc2)=O

InChI

InChI=1S/C21H18ClN3O2S/c22-17-10-4-7-13-20(17)28(26,27)23-14-15-25-19-12-6-5-11-18(19)24-21(25)16-8-2-1-3-9-16/h1-13,23H,14-15H2

InChI Key

MROUFWVRDAJYJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27133841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.056

Distribution Coefficient, logD

5.053

Water Solubility, LogSw

-5.38

Polar Surface Area

51.745

Acid Dissociation Constant (pKa)

11.51

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

F485-0563 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F485-0563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F485-0563?
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What is the minimum amount of F485-0563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F485-0563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F485-0563
  • 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 F485-0563 available by request