SC18-0141 Screening compound: 2-(1-azepanyl)-N-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)acetamide

SC18-0141 Screening compound: 2-(1-azepanyl)-N-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)acetamide
SC18-0141 Screening compound: 2-(1-azepanyl)-N-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC18-0141
2-(1-azepanyl)-N-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)acetamide

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

SC18-0141

Molecular Formula

C17H29N5O4S (C17 H29 N5 O4 S)

Compound Name

2-(1-azepanyl)-N-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)acetamide

IUPAC name

2-(azepan-1-yl)-N-{[3-(1-methanesulfonylpiperidin-4-yl)-124-oxadiazol-5-yl]methyl}acetamide

SMILES

CS(N(CC1)CCC1c1noc(CNC(CN2CCCCCC2)=O)n1)(=O)=O

InChI

InChI=1S/C17H29N5O4S/c1-27(24,25)22-10-6-14(7-11-22)17-19-16(26-20-17)12-18-15(23)13-21-8-4-2-3-5-9-21/h14H,2-13H2,1H3,(H,18,23)

InChI Key

MLHHOWFDPVOKPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32255782

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.522

Distribution Coefficient, logD

1.459

Water Solubility, LogSw

-2.08

Polar Surface Area

91.591

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

82.35

SC18-0141 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 SC18-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC18-0141?
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What is the minimum amount of SC18-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC18-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC18-0141
  • 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 SC18-0141 available by request