K841-0095 Screening compound: 4-[4-(4-fluorophenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

K841-0095 Screening compound: 4-[4-(4-fluorophenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
K841-0095 Screening compound: 4-[4-(4-fluorophenyl)piperazino]-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound K841-0095
4-[4-(4-fluorophenyl)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

K841-0095

Molecular Formula

C21H23FN4S (C21 H23 FN4 S)

Compound Name

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

IUPAC name

3-[4-(4-fluorophenyl)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(cc2)ccc2F)c(c(CCCC2)c2s2)c2n1

InChI

InChI=1S/C21H23FN4S/c1-14-23-20(19-17-4-2-3-5-18(17)27-21(19)24-14)26-12-10-25(11-13-26)16-8-6-15(22)7-9-16/h6-9H,2-5,10-13H2,1H3

InChI Key

UWONNKGWCZJWFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15110555

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.5

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.406

Distribution Coefficient, logD

5.124

Water Solubility, LogSw

-5.55

Polar Surface Area

26.094

Acid Dissociation Constant (pKa)

22.15

Base Dissociation Constant (pKb)

7.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with K841-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K841-0095?
Check Price and Availability of K841-0095, 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 K841-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K841-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K841-0095
  • 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 K841-0095 available by request