SC17-0132 Screening compound: N~1~-(2-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}ethyl)-3-piperidinopropanamide

SC17-0132 Screening compound: N~1~-(2-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}ethyl)-3-piperidinopropanamide
SC17-0132 Screening compound: N~1~-(2-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}ethyl)-3-piperidinopropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC17-0132
N~1~-(2-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}ethyl)-3-piperidinopropanamide

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

SC17-0132

Molecular Formula

C18H31N5O4S (C18 H31 N5 O4 S)

Compound Name

N~1~-(2-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}ethyl)-3-piperidinopropanamide

IUPAC name

N-{2-[3-(1-methanesulfonylpiperidin-4-yl)-124-oxadiazol-5-yl]ethyl}-3-(piperidin-1-yl)propanamide

SMILES

CS(N(CC1)CCC1c1noc(CCNC(CCN2CCCCC2)=O)n1)(=O)=O

InChI

InChI=1S/C18H31N5O4S/c1-28(25,26)23-13-6-15(7-14-23)18-20-17(27-21-18)5-9-19-16(24)8-12-22-10-3-2-4-11-22/h15H,2-14H2,1H3,(H,19,24)

InChI Key

AKQKDJUVNXOAPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32255535

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.376

Distribution Coefficient, logD

-1.657

Water Solubility, LogSw

-1.59

Polar Surface Area

91.080

Acid Dissociation Constant (pKa)

15.05

Base Dissociation Constant (pKb)

9.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

83.33

SC17-0132 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 SC17-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC17-0132?
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What is the minimum amount of SC17-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC17-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC17-0132
  • 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 SC17-0132 available by request