C274-8437 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2-phenylethyl)piperidine-3-carboxamide

C274-8437 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2-phenylethyl)piperidine-3-carboxamide
C274-8437 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2-phenylethyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-8437
1-(2,1,3-benzoxadiazole-4-sulfonyl)-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

C274-8437

Molecular Formula

C20H22N4O4S (C20 H22 N4 O4 S)

Compound Name

1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2-phenylethyl)piperidine-3-carboxamide

IUPAC name

1-(213-benzoxadiazole-4-sulfonyl)-N-(2-phenylethyl)piperidine-3-carboxamide

SMILES

O=C(C(CCC1)CN1S(c1cccc2nonc12)(=O)=O)NCCc1ccccc1

InChI

InChI=1S/C20H22N4O4S/c25-20(21-12-11-15-6-2-1-3-7-15)16-8-5-13-24(14-16)29(26,27)18-10-4-9-17-19(18)23-28-22-17/h1-4,6-7,9-10,16H,5,8,11-14H2,(H,21,25)/t16-/m0/s1

InChI Key

LZBYCHOULVFWJX-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14740518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.468

Distribution Coefficient, logD

2.468

Water Solubility, LogSw

-2.70

Polar Surface Area

92.227

Acid Dissociation Constant (pKa)

13.32

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

C274-8437 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C274-8437 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-8437?
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What is the minimum amount of C274-8437 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-8437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-8437
  • 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 C274-8437 available by request