K696-0134 Screening compound: 4-[4-(2-methoxyphenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

K696-0134 Screening compound: 4-[4-(2-methoxyphenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
K696-0134 Screening compound: 4-[4-(2-methoxyphenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound K696-0134
4-[4-(2-methoxyphenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

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

K696-0134

Molecular Formula

C22H26N4OS (C22 H26 N4 OS)

Compound Name

4-[4-(2-methoxyphenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

IUPAC name

3-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methyl-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraene

SMILES

Cc1nc(N(CC2)CCN2c(cccc2)c2OC)c(c(CCCC2)c2s2)c2n1

InChI

InChI=1S/C22H26N4OS/c1-15-23-21(20-16-7-3-6-10-19(16)28-22(20)24-15)26-13-11-25(12-14-26)17-8-4-5-9-18(17)27-2/h4-5,8-9H,3,6-7,10-14H2,1-2H3

InChI Key

PZTQIFOOPSPYIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02329079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.257

Distribution Coefficient, logD

4.974

Water Solubility, LogSw

-5.28

Polar Surface Area

33.423

Acid Dissociation Constant (pKa)

22.15

Base Dissociation Constant (pKb)

7.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

K696-0134 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K696-0134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K696-0134?
Check Price and Availability of K696-0134, 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 K696-0134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K696-0134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K696-0134
  • 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 K696-0134 available by request