C274-6057 Screening compound: N-(1-BENZYL-4-PIPERIDYL)-2-{[(5-BROMO-2-THIENYL)SULFONYL]AMINO}-3-PHENYLPROPANAMIDE

C274-6057 Screening compound: N-(1-BENZYL-4-PIPERIDYL)-2-{[(5-BROMO-2-THIENYL)SULFONYL]AMINO}-3-PHENYLPROPANAMIDE
C274-6057 Screening compound: N-(1-BENZYL-4-PIPERIDYL)-2-{[(5-BROMO-2-THIENYL)SULFONYL]AMINO}-3-PHENYLPROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-6057
N-(1-BENZYL-4-PIPERIDYL)-2-{[(5-BROMO-2-THIENYL)SULFONYL]AMINO}-3-PHENYLPROPANAMIDE

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

C274-6057

Molecular Formula

C25H28BrN3O3S2 (C25 H28 BrN3 O3 S2)

Compound Name

N-(1-BENZYL-4-PIPERIDYL)-2-{[(5-BROMO-2-THIENYL)SULFONYL]AMINO}-3-PHENYLPROPANAMIDE

IUPAC name

n/a

SMILES

O=C(C(Cc1ccccc1)NS(c(s1)ccc1Br)(=O)=O)NC1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C25H28BrN3O3S2/c26-23-11-12-24(33-23)34(31,32)28-22(17-19-7-3-1-4-8-19)25(30)27-21-13-15-29(16-14-21)18-20-9-5-2-6-10-20/h1-12,21-22,28H,13-18H2,(H,27,30)/t22-/m0/s1

InChI Key

MDPXNOBERJYHNX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14740437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

562.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.778

Distribution Coefficient, logD

3.220

Water Solubility, LogSw

-4.65

Polar Surface Area

70.538

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.00

C274-6057 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C274-6057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-6057?
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What is the minimum amount of C274-6057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-6057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-6057
  • 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 C274-6057 available by request