SC16-0223 Screening compound: 1-{4-[5-({1-[(4-isopropylphenyl)sulfonyl]-3-azetanyl}methyl)-1,2,4-oxadiazol-3-yl]piperidino}-1-ethanone

SC16-0223 Screening compound: 1-{4-[5-({1-[(4-isopropylphenyl)sulfonyl]-3-azetanyl}methyl)-1,2,4-oxadiazol-3-yl]piperidino}-1-ethanone
SC16-0223 Screening compound: 1-{4-[5-({1-[(4-isopropylphenyl)sulfonyl]-3-azetanyl}methyl)-1,2,4-oxadiazol-3-yl]piperidino}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC16-0223
1-{4-[5-({1-[(4-isopropylphenyl)sulfonyl]-3-azetanyl}methyl)-1,2,4-oxadiazol-3-yl]piperidino}-1-ethanone

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

SC16-0223

Molecular Formula

C22H30N4O4S (C22 H30 N4 O4 S)

Compound Name

1-{4-[5-({1-[(4-isopropylphenyl)sulfonyl]-3-azetanyl}methyl)-1,2,4-oxadiazol-3-yl]piperidino}-1-ethanone

IUPAC name

1-{4-[5-({1-[4-(propan-2-yl)benzenesulfonyl]azetidin-3-yl}methyl)-124-oxadiazol-3-yl]piperidin-1-yl}ethan-1-one

SMILES

CC(C)c(cc1)ccc1S(N1CC(Cc2nc(C(CC3)CCN3C(C)=O)no2)C1)(=O)=O

InChI

InChI=1S/C22H30N4O4S/c1-15(2)18-4-6-20(7-5-18)31(28,29)26-13-17(14-26)12-21-23-22(24-30-21)19-8-10-25(11-9-19)16(3)27/h4-7,15,17,19H,8-14H2,1-3H3

InChI Key

DZVZLLSMZGQWSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32255888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.639

Distribution Coefficient, logD

3.639

Water Solubility, LogSw

-3.68

Polar Surface Area

80.606

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.09

References: we are preparing a list of scientific research reports with SC16-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC16-0223?
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What is the minimum amount of SC16-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC16-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC16-0223
  • 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 SC16-0223 available by request