S727-1767 Screening compound: 4-[(benzyloxy)methyl]-1-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)azetidin-3-yl]-1H-1,2,3-triazole

S727-1767 Screening compound: 4-[(benzyloxy)methyl]-1-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)azetidin-3-yl]-1H-1,2,3-triazole
S727-1767 Screening compound: 4-[(benzyloxy)methyl]-1-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)azetidin-3-yl]-1H-1,2,3-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound S727-1767
4-[(benzyloxy)methyl]-1-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)azetidin-3-yl]-1H-1,2,3-triazole

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

S727-1767

Molecular Formula

C19H21N5O3 (C19 H21 N5 O3)

Compound Name

4-[(benzyloxy)methyl]-1-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)azetidin-3-yl]-1H-1,2,3-triazole

IUPAC name

4-[(benzyloxy)methyl]-1-[1-(35-dimethyl-12-oxazole-4-carbonyl)azetidin-3-yl]-1H-123-triazole

SMILES

Cc1noc(C)c1C(N(C1)CC1n1nnc(COCc2ccccc2)c1)=O

InChI

InChI=1S/C19H21N5O3/c1-13-18(14(2)27-21-13)19(25)23-9-17(10-23)24-8-16(20-22-24)12-26-11-15-6-4-3-5-7-15/h3-8,17H,9-12H2,1-2H3

InChI Key

RQRUXLVREHECHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31968266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.242

Distribution Coefficient, logD

1.242

Water Solubility, LogSw

-1.33

Polar Surface Area

73.787

Acid Dissociation Constant (pKa)

24.31

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

S727-1767 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S727-1767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S727-1767?
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What is the minimum amount of S727-1767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S727-1767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S727-1767
  • 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 S727-1767 available by request