C259-0415 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(3-chloro-2-methylphenyl)piperidine-4-carboxamide

C259-0415 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(3-chloro-2-methylphenyl)piperidine-4-carboxamide
C259-0415 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(3-chloro-2-methylphenyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C259-0415
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(3-chloro-2-methylphenyl)piperidine-4-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

C259-0415

Molecular Formula

C19H19ClN4O4S (C19 H19 ClN4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(c(NC(C(CC1)CCN1S(c1cccc2nonc12)(=O)=O)=O)ccc1)c1Cl

InChI

InChI=1S/C19H19ClN4O4S/c1-12-14(20)4-2-5-15(12)21-19(25)13-8-10-24(11-9-13)29(26,27)17-7-3-6-16-18(17)23-28-22-16/h2-7,13H,8-11H2,1H3,(H,21,25)

InChI Key

HKWLUCDLFXKCRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.795

Distribution Coefficient, logD

3.794

Water Solubility, LogSw

-4.11

Polar Surface Area

90.433

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

C259-0415 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with C259-0415 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C259-0415?
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What is the minimum amount of C259-0415 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C259-0415
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C259-0415
  • 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 C259-0415 available by request