C566-0090 Screening compound: 8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one

C566-0090 Screening compound: 8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one
C566-0090 Screening compound: 8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C566-0090
8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one

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

C566-0090

Molecular Formula

C19H18O5S (C19 H18 O5 S)

Compound Name

8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one

IUPAC name

8-methoxy-3-[4-(propan-2-yl)benzenesulfonyl]-2H-chromen-2-one

SMILES

CC(C)c(cc1)ccc1S(C1=Cc(cccc2OC)c2OC1=O)(=O)=O

InChI

InChI=1S/C19H18O5S/c1-12(2)13-7-9-15(10-8-13)25(21,22)17-11-14-5-4-6-16(23-3)18(14)24-19(17)20/h4-12H,1-3H3

InChI Key

PDGFJIGLFACCPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04444907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.065

Distribution Coefficient, logD

4.065

Water Solubility, LogSw

-4.33

Polar Surface Area

57.976

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with C566-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C566-0090?
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What is the minimum amount of C566-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C566-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C566-0090
  • 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 C566-0090 available by request