C200-5072 Screening compound: 5-[4-(4-fluorophenyl)piperazino]-3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine

C200-5072 Screening compound: 5-[4-(4-fluorophenyl)piperazino]-3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
C200-5072 Screening compound: 5-[4-(4-fluorophenyl)piperazino]-3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-5072
5-[4-(4-fluorophenyl)piperazino]-3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]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

C200-5072

Molecular Formula

C26H25FN6O2S2 (C26 H25 FN6 O2 S2)

Compound Name

5-[4-(4-fluorophenyl)piperazino]-3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine

IUPAC name

7-[4-(4-fluorophenyl)piperazin-1-yl]-10-[4-(propan-2-yl)benzenesulfonyl]-5-thia-181112-tetraazatricyclo[7.3.0.0^{26}]dodeca-2(6)37911-pentaene

SMILES

CC(C)c(cc1)ccc1S(c(nnn1c2c3scc2)c1nc3N(CC1)CCN1c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C26H25FN6O2S2/c1-17(2)18-3-9-21(10-4-18)37(34,35)26-25-28-24(23-22(11-16-36-23)33(25)30-29-26)32-14-12-31(13-15-32)20-7-5-19(27)6-8-20/h3-11,16-17H,12-15H2,1-2H3

InChI Key

KDNGPOAAVFUWGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.240

Distribution Coefficient, logD

6.240

Water Solubility, LogSw

-5.74

Polar Surface Area

69.407

Acid Dissociation Constant (pKa)

22.73

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

C200-5072 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with C200-5072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-5072?
Check Price and Availability of C200-5072, 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 C200-5072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-5072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-5072
  • 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 C200-5072 available by request