F864-0487 Screening compound: ethyl 1-{1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate

F864-0487 Screening compound: ethyl 1-{1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate
F864-0487 Screening compound: ethyl 1-{1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F864-0487
ethyl 1-{1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate

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

F864-0487

Molecular Formula

C24H29N5O5S (C24 H29 N5 O5 S)

Compound Name

ethyl 1-{1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{1-[5-(phenylcarbamoyl)-134-thiadiazole-2-carbonyl]piperidine-3-carbonyl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(C(CCC1)CN1C(c1nnc(C(Nc2ccccc2)=O)s1)=O)=O)=O

InChI

InChI=1S/C24H29N5O5S/c1-2-34-24(33)16-10-13-28(14-11-16)22(31)17-7-6-12-29(15-17)23(32)21-27-26-20(35-21)19(30)25-18-8-4-3-5-9-18/h3-5,8-9,16-17H,2,6-7,10-15H2,1H3,(H,25,30)/t17-/m0/s1

InChI Key

CRFIRAZMXIRJGP-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27200480

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.943

Distribution Coefficient, logD

1.942

Water Solubility, LogSw

-2.54

Polar Surface Area

100.817

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

F864-0487 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with F864-0487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F864-0487?
Check Price and Availability of F864-0487, 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 F864-0487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F864-0487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F864-0487
  • 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 F864-0487 available by request