8018-3644 Screening compound: 1,4-bis(thiophene-2-sulfonyl)-1,4-diazepane

8018-3644 Screening compound: 1,4-bis(thiophene-2-sulfonyl)-1,4-diazepane
8018-3644 Screening compound: 1,4-bis(thiophene-2-sulfonyl)-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3644
1,4-bis(thiophene-2-sulfonyl)-1,4-diazepane

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

8018-3644

Molecular Formula

C13H16N2O4S4 (C13 H16 N2 O4 S4)

Compound Name

1,4-bis(thiophene-2-sulfonyl)-1,4-diazepane

IUPAC name

14-bis(thiophene-2-sulfonyl)-14-diazepane

SMILES

O=S(c1cccs1)(N(CCC1)CCN1S(c1cccs1)(=O)=O)=O

InChI

InChI=1S/C13H16N2O4S4/c16-22(17,12-4-1-10-20-12)14-6-3-7-15(9-8-14)23(18,19)13-5-2-11-21-13/h1-2,4-5,10-11H,3,6-9H2

InChI Key

NHJDMNBVCKUTTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07397343

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.831

Distribution Coefficient, logD

1.831

Water Solubility, LogSw

-2.25

Polar Surface Area

65.836

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-7.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with 8018-3644 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3644?
Check Price and Availability of 8018-3644, 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 8018-3644 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3644
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3644
  • 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 8018-3644 available by request