S724-1334 Screening compound: 1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-1,2,3-triazole-4-carboxamide

S724-1334 Screening compound: 1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-1,2,3-triazole-4-carboxamide
S724-1334 Screening compound: 1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S724-1334
1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-1,2,3-triazole-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

S724-1334

Molecular Formula

C18H27N5O2 (C18 H27 N5 O2)

Compound Name

1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

1-[1-(2-cyclohexylacetyl)azetidin-3-yl]-N-(cyclopropylmethyl)-1H-123-triazole-4-carboxamide

SMILES

O=C(CC1CCCCC1)N(C1)CC1n1nnc(C(NCC2CC2)=O)c1

InChI

InChI=1S/C18H27N5O2/c24-17(8-13-4-2-1-3-5-13)22-10-15(11-22)23-12-16(20-21-23)18(25)19-9-14-6-7-14/h12-15H,1-11H2,(H,19,25)

InChI Key

AVTLATDXDAQZCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31983155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.920

Distribution Coefficient, logD

1.920

Water Solubility, LogSw

-2.27

Polar Surface Area

67.692

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

77.78

S724-1334 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S724-1334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S724-1334?
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What is the minimum amount of S724-1334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S724-1334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S724-1334
  • 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 S724-1334 available by request