P768-0223 Screening compound: 5-[4-(2-FLUOROPHENYL)PIPERAZINE-1-CARBONYL]-1-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-1,3-BENZODIAZOLE

P768-0223 Screening compound: 5-[4-(2-FLUOROPHENYL)PIPERAZINE-1-CARBONYL]-1-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-1,3-BENZODIAZOLE
P768-0223 Screening compound: 5-[4-(2-FLUOROPHENYL)PIPERAZINE-1-CARBONYL]-1-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-1,3-BENZODIAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound P768-0223
5-[4-(2-FLUOROPHENYL)PIPERAZINE-1-CARBONYL]-1-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-1,3-BENZODIAZOLE

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

P768-0223

Molecular Formula

C24H28FN5O (C24 H28 FN5 O)

Compound Name

5-[4-(2-FLUOROPHENYL)PIPERAZINE-1-CARBONYL]-1-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-1,3-BENZODIAZOLE

IUPAC name

5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-13-benzodiazole

SMILES

O=C(c(cc1)cc2c1n(CCN1CCCC1)cn2)N(CC1)CCN1c(cccc1)c1F

InChI

InChI=1S/C24H28FN5O/c25-20-5-1-2-6-22(20)28-13-15-29(16-14-28)24(31)19-7-8-23-21(17-19)26-18-30(23)12-11-27-9-3-4-10-27/h1-2,5-8,17-18H,3-4,9-16H2

InChI Key

OTFYYYHJFRYXJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.427

Distribution Coefficient, logD

1.406

Water Solubility, LogSw

-2.72

Polar Surface Area

34.358

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

8.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

P768-0223 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P768-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P768-0223?
Check Price and Availability of P768-0223, 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 P768-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P768-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P768-0223
  • 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 P768-0223 available by request