SC23-0406 Screening compound: N-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethyl]-N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]-3-azetanyl}methanesulfonamide

SC23-0406 Screening compound: N-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethyl]-N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]-3-azetanyl}methanesulfonamide
SC23-0406 Screening compound: N-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethyl]-N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]-3-azetanyl}methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC23-0406
N-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethyl]-N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]-3-azetanyl}methanesulfonamide

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

SC23-0406

Molecular Formula

C18H28N6O4S (C18 H28 N6 O4 S)

Compound Name

N-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethyl]-N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]-3-azetanyl}methanesulfonamide

IUPAC name

N-{1-[2-(2-methyl-1H-imidazol-1-yl)acetyl]azetidin-3-yl}-N-{2-[5-(2-methylpropyl)-124-oxadiazol-3-yl]ethyl}methanesulfonamide

SMILES

CC(C)Cc1nc(CCN(C(C2)CN2C(Cn2c(C)ncc2)=O)S(C)(=O)=O)no1

InChI

InChI=1S/C18H28N6O4S/c1-13(2)9-17-20-16(21-28-17)5-7-24(29(4,26)27)15-10-23(11-15)18(25)12-22-8-6-19-14(22)3/h6,8,13,15H,5,7,9-12H2,1-4H3

InChI Key

WQLXPXBFTCXBES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32256079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.52

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.298

Distribution Coefficient, logD

-0.727

Water Solubility, LogSw

-1.52

Polar Surface Area

92.658

Acid Dissociation Constant (pKa)

18.56

Base Dissociation Constant (pKb)

8.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

SC23-0406 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 SC23-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC23-0406?
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What is the minimum amount of SC23-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC23-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC23-0406
  • 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 SC23-0406 available by request