5227-6180 Screening compound: 4-methyl-N-[2-(pyridin-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzene-1-sulfonamide

5227-6180 Screening compound: 4-methyl-N-[2-(pyridin-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzene-1-sulfonamide
5227-6180 Screening compound: 4-methyl-N-[2-(pyridin-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5227-6180
4-methyl-N-[2-(pyridin-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]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

5227-6180

Molecular Formula

C24H20N2O2S2 (C24 H20 N2 O2 S2)

Compound Name

4-methyl-N-[2-(pyridin-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzene-1-sulfonamide

IUPAC name

4-methyl-N-[2-(pyridin-2-ylsulfanyl)-12-dihydroacenaphthylen-1-yl]benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NC(C1Sc2ncccc2)c2cccc3cccc1c23)(=O)=O

InChI

InChI=1S/C24H20N2O2S2/c1-16-11-13-18(14-12-16)30(27,28)26-23-19-8-4-6-17-7-5-9-20(22(17)19)24(23)29-21-10-2-3-15-25-21/h2-15,23-24,26H,1H3

InChI Key

HUFOBPILAZTOQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03681222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.813

Distribution Coefficient, logD

5.810

Water Solubility, LogSw

-6.37

Polar Surface Area

50.676

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 5227-6180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5227-6180?
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What is the minimum amount of 5227-6180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5227-6180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5227-6180
  • 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 5227-6180 available by request