G520-0079 Screening compound: 4,5-dihydrothieno[2,3-e][1]benzothiophen-2-yl[4-(4-methoxyphenyl)piperazino]methanone

G520-0079 Screening compound: 4,5-dihydrothieno[2,3-e][1]benzothiophen-2-yl[4-(4-methoxyphenyl)piperazino]methanone
G520-0079 Screening compound: 4,5-dihydrothieno[2,3-e][1]benzothiophen-2-yl[4-(4-methoxyphenyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound G520-0079
4,5-dihydrothieno[2,3-e][1]benzothiophen-2-yl[4-(4-methoxyphenyl)piperazino]methanone

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

G520-0079

Molecular Formula

C22H22N2O2S2 (C22 H22 N2 O2 S2)

Compound Name

4,5-dihydrothieno[2,3-e][1]benzothiophen-2-yl[4-(4-methoxyphenyl)piperazino]methanone

IUPAC name

1-{310-dithiatricyclo[7.3.0.0^{26}]dodeca-1(9)2(6)411-tetraene-4-carbonyl}-4-(4-methoxyphenyl)piperazine

SMILES

COc(cc1)ccc1N(CC1)CCN1C(c1cc(CCc2c-3ccs2)c3s1)=O

InChI

InChI=1S/C22H22N2O2S2/c1-26-17-5-3-16(4-6-17)23-9-11-24(12-10-23)22(25)20-14-15-2-7-19-18(8-13-27-19)21(15)28-20/h3-6,8,13-14H,2,7,9-12H2,1H3

InChI Key

HRAXZWWGIIGBOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15015370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.56

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.038

Distribution Coefficient, logD

5.038

Water Solubility, LogSw

-4.73

Polar Surface Area

29.377

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

7.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with G520-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G520-0079?
Check Price and Availability of G520-0079, 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 G520-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G520-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G520-0079
  • 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 G520-0079 available by request