3019-0285 Screening compound: 1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane

3019-0285 Screening compound: 1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane
3019-0285 Screening compound: 1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 3019-0285
1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane

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

3019-0285

Molecular Formula

C24H32N2O4S3 (C24 H32 N2 O4 S3)

Compound Name

1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane

IUPAC name

1-(4-{[4-(azepane-1-sulfonyl)phenyl]sulfanyl}benzenesulfonyl)azepane

SMILES

O=S(c(cc1)ccc1Sc(cc1)ccc1S(N1CCCCCC1)(=O)=O)(N1CCCCCC1)=O

InChI

InChI=1S/C24H32N2O4S3/c27-32(28,25-17-5-1-2-6-18-25)23-13-9-21(10-14-23)31-22-11-15-24(16-12-22)33(29,30)26-19-7-3-4-8-20-26/h9-16H,1-8,17-20H2

InChI Key

DWCHYLFQJRMPKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01122330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.73

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.626

Distribution Coefficient, logD

5.626

Water Solubility, LogSw

-5.71

Polar Surface Area

64.051

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 3019-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3019-0285?
Check Price and Availability of 3019-0285, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3019-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3019-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3019-0285
  • 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 3019-0285 available by request