E146-0868 Screening compound: 1-(4-methoxyphenyl)-4-{4H-thiochromeno[3,4-d][1,2]oxazole-3-carbonyl}piperazine

E146-0868 Screening compound: 1-(4-methoxyphenyl)-4-{4H-thiochromeno[3,4-d][1,2]oxazole-3-carbonyl}piperazine
E146-0868 Screening compound: 1-(4-methoxyphenyl)-4-{4H-thiochromeno[3,4-d][1,2]oxazole-3-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E146-0868
1-(4-methoxyphenyl)-4-{4H-thiochromeno[3,4-d][1,2]oxazole-3-carbonyl}piperazine

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

E146-0868

Molecular Formula

C22H21N3O3S (C22 H21 N3 O3 S)

Compound Name

1-(4-methoxyphenyl)-4-{4H-thiochromeno[3,4-d][1,2]oxazole-3-carbonyl}piperazine

IUPAC name

1-(4-methoxyphenyl)-4-{4H-thiochromeno[34-d][12]oxazole-3-carbonyl}piperazine

SMILES

COc(cc1)ccc1N(CC1)CCN1C(c1noc-2c1CSc1c2cccc1)=O

InChI

InChI=1S/C22H21N3O3S/c1-27-16-8-6-15(7-9-16)24-10-12-25(13-11-24)22(26)20-18-14-29-19-5-3-2-4-17(19)21(18)28-23-20/h2-9H,10-14H2,1H3

InChI Key

USBIOEXEVOXNCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14842784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.737

Distribution Coefficient, logD

3.737

Water Solubility, LogSw

-4.10

Polar Surface Area

49.772

Acid Dissociation Constant (pKa)

19.32

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with E146-0868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E146-0868?
Check Price and Availability of E146-0868, 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 E146-0868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E146-0868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E146-0868
  • 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 E146-0868 available by request