SB75-0962 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-furylcarbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-ethanesulfonamide

SB75-0962 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-furylcarbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-ethanesulfonamide
SB75-0962 Screening compound: N~1~-[(3aR,5R,6aR)-2-(2-furylcarbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-ethanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB75-0962
N~1~-[(3aR,5R,6aR)-2-(2-furylcarbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-ethanesulfonamide

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

SB75-0962

Molecular Formula

C17H22N4O5S (C17 H22 N4 O5 S)

Compound Name

N~1~-[(3aR,5R,6aR)-2-(2-furylcarbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-1-ethanesulfonamide

IUPAC name

N-[(3aR5R6aR)-2-(furan-2-carbonyl)-3a-(3-methyl-124-oxadiazol-5-yl)-octahydrocyclopenta[c]pyrrol-5-yl]ethane-1-sulfonamide

SMILES

CCS(N[C@H](C[C@H]1CN(C2)C(c3ccco3)=O)C[C@]12c1nc(C)no1)(=O)=O

InChI

InChI=1S/C17H22N4O5S/c1-3-27(23,24)20-13-7-12-9-21(15(22)14-5-4-6-25-14)10-17(12,8-13)16-18-11(2)19-26-16/h4-6,12-13,20H,3,7-10H2,1-2H3/t12-,13-,17+/m1/s1

InChI Key

LNAXQCOJSMQAJG-XNJGSVPQSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.45

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.082

Distribution Coefficient, logD

1.082

Water Solubility, LogSw

-2.34

Polar Surface Area

100.678

Acid Dissociation Constant (pKa)

11.82

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

58.82

References: we are preparing a list of scientific research reports with SB75-0962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB75-0962?
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What is the minimum amount of SB75-0962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB75-0962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB75-0962
  • 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 SB75-0962 available by request