3506-0073 Screening compound: 1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]benzenesulfonyl}azepane

3506-0073 Screening compound: 1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]benzenesulfonyl}azepane
3506-0073 Screening compound: 1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]benzenesulfonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 3506-0073
1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]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

3506-0073

Molecular Formula

C24H32N2O6S3 (C24 H32 N2 O6 S3)

Compound Name

1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]benzenesulfonyl}azepane

IUPAC name

1-{3-[3-(azepane-1-sulfonyl)benzenesulfonyl]benzenesulfonyl}azepane

SMILES

O=S(c1cc(S(N2CCCCCC2)(=O)=O)ccc1)(c1cccc(S(N2CCCCCC2)(=O)=O)c1)=O

InChI

InChI=1S/C24H32N2O6S3/c27-33(28,21-11-9-13-23(19-21)34(29,30)25-15-5-1-2-6-16-25)22-12-10-14-24(20-22)35(31,32)26-17-7-3-4-8-18-26/h9-14,19-20H,1-8,15-18H2

InChI Key

KYWGXIIBLGGJHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01203079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

540.73

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.217

Distribution Coefficient, logD

4.217

Water Solubility, LogSw

-4.20

Polar Surface Area

93.823

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

-4.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 3506-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3506-0073?
Check Price and Availability of 3506-0073, 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 3506-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3506-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3506-0073
  • 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 3506-0073 available by request