E017-0422 Screening compound: 1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide

E017-0422 Screening compound: 1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide
E017-0422 Screening compound: 1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E017-0422
1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide

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

E017-0422

Molecular Formula

C20H25N5O2S (C20 H25 N5 O2 S)

Compound Name

1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide

IUPAC name

1-[5-(2-oxopyrrolidin-1-yl)-134-thiadiazol-2-yl]-N-(2-phenylethyl)piperidine-3-carboxamide

SMILES

O=C(C(CCC1)CN1c1nnc(N(CCC2)C2=O)s1)NCCc1ccccc1

InChI

InChI=1S/C20H25N5O2S/c26-17-9-5-13-25(17)20-23-22-19(28-20)24-12-4-8-16(14-24)18(27)21-11-10-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2,(H,21,27)/t16-/m0/s1

InChI Key

OXRJHYAJPPNBSN-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14838964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.187

Distribution Coefficient, logD

2.187

Water Solubility, LogSw

-2.53

Polar Surface Area

67.830

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with E017-0422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E017-0422?
Check Price and Availability of E017-0422, 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 E017-0422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E017-0422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E017-0422
  • 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 E017-0422 available by request