8018-3645 Screening compound: 1,4-bis(dibenzo[b,d]furan-2-ylsulfonyl)-1,4-diazepane

8018-3645 Screening compound: 1,4-bis(dibenzo[b,d]furan-2-ylsulfonyl)-1,4-diazepane
8018-3645 Screening compound: 1,4-bis(dibenzo[b,d]furan-2-ylsulfonyl)-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3645
1,4-bis(dibenzo[b,d]furan-2-ylsulfonyl)-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

8018-3645

Molecular Formula

C29H24N2O6S2 (C29 H24 N2 O6 S2)

Compound Name

1,4-bis(dibenzo[b,d]furan-2-ylsulfonyl)-1,4-diazepane

IUPAC name

14-bis({8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaene-4-sulfonyl})-14-diazepane

SMILES

O=S(c(cc1)cc2c1oc1c2cccc1)(N(CCC1)CCN1S(c(cc1)cc2c1oc1c2cccc1)(=O)=O)=O

InChI

InChI=1S/C29H24N2O6S2/c32-38(33,20-10-12-28-24(18-20)22-6-1-3-8-26(22)36-28)30-14-5-15-31(17-16-30)39(34,35)21-11-13-29-25(19-21)23-7-2-4-9-27(23)37-29/h1-4,6-13,18-19H,5,14-17H2

InChI Key

QETLTYQDYREWGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07658221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

560.65

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.663

Distribution Coefficient, logD

6.663

Water Solubility, LogSw

-6.45

Polar Surface Area

79.629

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-7.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.20

References: we are preparing a list of scientific research reports with 8018-3645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3645?
Check Price and Availability of 8018-3645, 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 8018-3645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3645
  • 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 8018-3645 available by request