6807-0570 Screening compound: N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl}butanamide

6807-0570 Screening compound: N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl}butanamide
6807-0570 Screening compound: N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6807-0570
N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl}butanamide

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

6807-0570

Molecular Formula

C22H19NO6S2 (C22 H19 NO6 S2)

Compound Name

N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl}butanamide

IUPAC name

N-(4-methoxybenzenesulfonyl)-N-{2-oxo-2H-naphtho[21-d][13]oxathiol-5-yl}butanamide

SMILES

CCCC(N(c(c1ccccc11)cc(S2)c1OC2=O)S(c(cc1)ccc1OC)(=O)=O)=O

InChI

InChI=1S/C22H19NO6S2/c1-3-6-20(24)23(31(26,27)15-11-9-14(28-2)10-12-15)18-13-19-21(29-22(25)30-19)17-8-5-4-7-16(17)18/h4-5,7-13H,3,6H2,1-2H3

InChI Key

YCZRFLOCOYCFEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05718631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.813

Distribution Coefficient, logD

4.813

Water Solubility, LogSw

-4.84

Polar Surface Area

74.018

Acid Dissociation Constant (pKa)

21.04

Base Dissociation Constant (pKb)

-15.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 6807-0570 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6807-0570?
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What is the minimum amount of 6807-0570 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6807-0570
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6807-0570
  • 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 6807-0570 available by request